Model name: model_name=MEAM_LAMMPS_AsadiZaeemNouranian_2015_Cu__MO_390178379548_000 a1: a1=[-1, 1, 0] a2: a2=[0, 0, 1] a3: a3=[1, 1, 0] Species: species=Cu Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.620386697351933 cohesive_energy=3.540278409370103 mass=63.546 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=180.0 Max. denominator: max_denominator=8 Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5 Min. number unit cell repetitions along x direction: x_repeat=1 Min. number unit cell repetitions along z direction: z_repeat=1 Min. cell height (Angstroms): min_cell_height=10.0 Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25 Isolated atom energy: 0.0 eV ======================================== theta = 0.0 ======================================== Energy: 0.013646320321090023 Energy: 0.5419017538784483 Energy: 0.013646320321090023 Energy: 0.5419017538784483 Energy: 0.013646320321090023 Energy: 0.5419017538781356 Energy: 0.5419017538781356 Energy: 0.303890397027856 Energy: 0.5419017538781356 Energy: 0.30389039702754334 Energy: 0.5419017538781356 Energy: 0.303890397027856 Energy: 0.013646320321090023 Energy: 0.5419017538781356 Energy: 0.013646320321090023 Energy: 0.5419017538781356 Energy: 0.013646320321090023 Energy: 0.5419017538781356 Energy: 0.5419017538781356 Energy: 0.303890397027856 Energy: 0.5419017538781356 Energy: 0.5688659185458622 Energy: 0.5419017538781356 Energy: 0.8843239586897063 Energy: 0.013646320321090023 Energy: 0.5419017538781356 Energy: 0.013646320321090023 Energy: 0.5419017538784483 Energy: 0.013646320321090023 Energy: 0.5419017538784483 Energy: 0.5419017538781356 Energy: 0.30389039702816867 Energy: 0.5419017538781356 Energy: 0.8843239586891156 Energy: 0.5419017538781356 Energy: 0.7340488269914635 minimum gb energy = 0.013646320321090023 eV minimum distance = 2.40143532145564 Angstroms sigma value = 1 ======================================== theta = 20.049975724151484 ======================================== Energy: 0.9062633182635051 Energy: 1.0103813917540274 Energy: 0.9062633182635051 Energy: 1.0103813917547801 Energy: 0.9062633182635051 Energy: 1.0103813917547801 Energy: 1.042500871950287 Energy: 0.8492569357097605 Energy: 1.042500871950287 Energy: 0.8492569357097605 Energy: 1.042500871950287 Energy: 0.8492569357097605 Energy: 0.8820490935799147 Energy: 1.1190872491227586 Energy: 0.8820490935799147 Energy: 1.1190872491227586 Energy: 0.8820490935799147 Energy: 1.1190872491227586 Energy: 1.0629585432855302 Energy: 0.8904026608942334 Energy: 1.0629585432847777 Energy: 0.8904026608942334 Energy: 1.0629585432855302 Energy: 0.8904026608942334 Energy: 0.9126601476012925 Energy: 0.9884091975768966 Energy: 0.9126601476005399 Energy: 0.9884091975776491 Energy: 0.9126601476005399 Energy: 0.9884091975768966 Energy: 0.9304656575527744 Energy: 0.8484341171527204 Energy: 0.9304656575527744 Energy: 0.8484341171527204 Energy: 0.9304656575527744 Energy: 0.8484341171527204 Energy: 0.8835890592755364 Energy: 1.0370830980622183 Energy: 0.8835890592762891 Energy: 1.0370830980622183 Energy: 0.8835890592762891 Energy: 1.0370830980622183 Energy: 0.9210795389766314 Energy: 1.0529215991516314 Energy: 0.9210795389766314 Energy: 1.0529215991516314 Energy: 0.9210795389773841 Energy: 1.0529215991516314 Energy: 0.9658086633377042 Energy: 0.921763115193403 Energy: 0.9658086633377042 Energy: 0.921763115193403 Energy: 0.9658086633377042 Energy: 0.9217631151941557 Energy: 0.8477840636486978 Energy: 1.0485153545815176 Energy: 0.8477840636486978 Energy: 1.0485153545815176 Energy: 0.8477840636486978 Energy: 1.0485153545815176 Energy: 0.9591842064201788 Energy: 0.8374974059762248 Energy: 0.9591842064194264 Energy: 0.8374974059762248 Energy: 0.9591842064194264 Energy: 0.8374974059762248 Energy: 0.8065088119066277 Energy: 1.028867027417598 Energy: 0.806508811905875 Energy: 1.028867027417598 Energy: 0.806508811905875 Energy: 1.0288670274183502 Energy: 1.0622574466003412 Energy: 0.8314849075767534 Energy: 1.0622574466003412 Energy: 0.8314849075767534 Energy: 1.0622574466003412 Energy: 0.8314849075767534 Energy: 0.8650591644958437 Energy: 1.0761417961478468 Energy: 0.8650591644958437 Energy: 1.0761417961470943 Energy: 0.8650591644958437 Energy: 1.0761417961478468 Energy: 1.0747184870989435 Energy: 0.8578369616771905 Energy: 1.0747184870989435 Energy: 0.8578369616771905 Energy: 1.0747184870989435 Energy: 0.8578369616764381 Energy: 1.0598442000872117 Energy: 0.9707419136121227 Energy: 1.0598442000872117 Energy: 0.9707419136121227 Energy: 1.0598442000872117 Energy: 0.9707419136121227 Energy: 0.9512809808957559 Energy: 0.9470808822785498 Energy: 0.9512809808957559 Energy: 0.9470808822793025 Energy: 0.9512809808957559 Energy: 0.9470808822785498 Energy: 1.0231984034815214 Energy: 0.9123796477915727 Energy: 1.0231984034815214 Energy: 0.91237964779082 Energy: 1.0231984034815214 Energy: 0.9123796477915727 Energy: 0.9137665062709824 Energy: 0.9844895871205646 Energy: 0.9137665062709824 Energy: 0.9844895871205646 Energy: 0.9137665062709824 Energy: 0.9844895871205646 Energy: 0.9495719936323587 Energy: 0.849058412989515 Energy: 0.9495719936323587 Energy: 0.849058412989515 Energy: 0.9495719936331113 Energy: 0.8490584129887626 Energy: 0.8626966340297343 Energy: 1.1235265301148545 Energy: 0.8626966340297343 Energy: 1.123526530115607 Energy: 0.8626966340297343 Energy: 1.1235265301148545 Energy: 1.0311654425982844 Energy: 0.8895589077385412 Energy: 1.0311654425975316 Energy: 0.8895589077385412 Energy: 1.0311654425982844 Energy: 0.8895589077392938 Energy: 0.8157992228009195 Energy: 1.0767379762132256 Energy: 0.8157992228001669 Energy: 1.0767379762132256 Energy: 0.8157992228001669 Energy: 1.0767379762124727 minimum gb energy = 0.806508811905875 eV minimum distance = 2.36711475796718 Angstroms sigma value = 33 ======================================== theta = 22.84350731792459 ======================================== Energy: 0.9358443428328942 Energy: 1.0528344174818725 Energy: 0.8856496735640957 Energy: 1.0528344174818725 Energy: 0.9358443428333224 Energy: 1.0528344174814444 Energy: 1.1427541295906314 Energy: 0.891544903500298 Energy: 1.1427541295919155 Energy: 0.891544903500298 Energy: 1.1427541295906314 Energy: 0.8915449035007262 Energy: 0.8509413868764383 Energy: 1.0034150568462097 Energy: 0.8509413868764383 Energy: 1.0034150568466378 Energy: 0.8509413868768665 Energy: 1.003415056847066 Energy: 1.089097634902424 Energy: 0.8949216685747932 Energy: 1.0890976349041366 Energy: 0.8949216685743652 Energy: 1.0890976349032804 Energy: 0.8949216685752215 Energy: 0.9778381636700958 Energy: 0.9467351580031383 Energy: 0.9778381636709521 Energy: 0.9467351580031383 Energy: 0.9778381636700958 Energy: 0.9467351580035663 Energy: 1.0133646375934358 Energy: 0.9592949501526652 Energy: 1.0133646375938639 Energy: 0.9592949501526652 Energy: 1.0133646375934358 Energy: 0.9592949501522371 Energy: 1.045632886180602 Energy: 0.8862215530864657 Energy: 1.04563288618103 Energy: 0.8862215530860377 Energy: 1.0456328861797457 Energy: 0.8862215530873219 Energy: 0.8311590989417563 Energy: 1.070055652125898 Energy: 0.8311590989421843 Energy: 1.0700556521254696 Energy: 0.831159098941328 Energy: 1.070055652125898 Energy: 0.9360437305702897 Energy: 0.8733528105285665 Energy: 0.9360437305702897 Energy: 0.8733528105289945 Energy: 0.9360437305698615 Energy: 0.8733528105285665 Energy: 0.8303603454700909 Energy: 1.0883800729379345 Energy: 0.8305717856747611 Energy: 1.0883800729383626 Energy: 0.8303603454696629 Energy: 1.0883800729379345 Energy: 1.0429873745594194 Energy: 0.854345770473047 Energy: 1.0429873745594194 Energy: 0.8543457704734752 Energy: 1.0429873745589915 Energy: 0.8543457704734752 Energy: 0.8507586753721291 Energy: 0.980323517985849 Energy: 0.8508936533469292 Energy: 0.9803235179871332 Energy: 0.8507586753721291 Energy: 0.980323517985849 Energy: 1.0520439365247733 Energy: 0.8641264224805041 Energy: 1.1212620236674637 Energy: 0.8641264224809321 Energy: 1.0520439365252015 Energy: 0.8641264224805041 Energy: 0.8870279222442385 Energy: 0.9992574908121081 Energy: 0.9371403307711186 Energy: 0.9992574908125361 Energy: 0.8870279222442385 Energy: 0.9992574908125361 Energy: 0.9329863317345485 Energy: 0.9330452283356743 Energy: 0.9329863317341205 Energy: 0.9330452283361024 Energy: 0.9329863317341205 Energy: 0.9330452283365305 Energy: 0.9602978014270139 Energy: 0.8872480264395657 Energy: 0.9602978014278701 Energy: 0.8872480264395657 Energy: 0.9602978014265857 Energy: 0.8872480264395657 Energy: 0.9760397536661025 Energy: 1.0098873136214015 Energy: 0.9760397536661025 Energy: 1.0098873136209734 Energy: 0.9760397536665306 Energy: 1.0098873136214015 Energy: 1.0126610538016971 Energy: 0.8662460938277843 Energy: 1.0126610538012688 Energy: 0.8662460938282124 Energy: 1.0126610538021252 Energy: 0.8662460938282124 Energy: 0.9152416060690063 Energy: 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0.8747309275875487 Energy: 1.0114892339718946 Energy: 0.9764196975209409 Energy: 1.0126161966450284 Energy: 1.0954059289512275 Energy: 1.0126161966446003 Energy: 0.976419697521797 Energy: 1.0126161966450284 Energy: 0.8867810464547847 Energy: 1.0427697748700235 Energy: 0.9359775977634818 Energy: 1.0427697748700235 Energy: 0.8867810464556408 Energy: 1.0427697748695952 Energy: 1.1153633767714524 Energy: 0.8325803497374747 Energy: 1.1153633767718807 Energy: 0.8325803497370468 Energy: 1.1153633767718807 Energy: 0.8325803497370468 Energy: 0.8508322672870622 Energy: 0.9196770987917506 Energy: 0.8508322672866342 Energy: 0.9196770987917506 Energy: 0.8508322672870622 Energy: 0.9196770987917506 minimum gb energy = 0.8303603454696629 eV minimum distance = 2.3979929445373 Angstroms sigma value = 51 ======================================== theta = 26.525352016609688 ======================================== Energy: 0.9514449203034497 Energy: 1.0408036415509854 Energy: 0.9514449203034497 Energy: 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0.9126397113717365 Energy: 0.927866606082056 Energy: 0.9250577100507268 Energy: 0.927866606082056 Energy: 0.9250577100507268 Energy: 0.9278666060830477 Energy: 0.9250577100507268 Energy: 0.8892975123670379 Energy: 0.9403834403512861 Energy: 0.8892975123670379 Energy: 0.9403834403512861 Energy: 0.8892975123670379 Energy: 0.9403834403522782 Energy: 1.021871634566568 Energy: 0.9311759995934163 Energy: 1.021871634566568 Energy: 0.9311759995944084 Energy: 1.021871634566568 Energy: 0.9311759995934163 Energy: 0.9588303937076633 Energy: 1.0896408039742915 Energy: 0.9588303937086552 Energy: 1.0896408039742915 Energy: 0.9588303937076633 Energy: 1.0896408039732997 Energy: 0.9529512585537421 Energy: 0.913558169511623 Energy: 0.9529512585537421 Energy: 0.913558169511623 Energy: 0.9529512585537421 Energy: 0.913558169511623 minimum gb energy = 0.8492730220646006 eV minimum distance = 2.30550879567866 Angstroms sigma value = 19 ======================================== theta = 31.586338096527925 ======================================== Energy: 0.8375667572895931 Energy: 0.8038942537851633 Energy: 0.8375667572895931 Energy: 0.8038942537851633 Energy: 0.8375667572895931 Energy: 0.8038942537851633 Energy: 0.9465354584484303 Energy: 0.933653680418632 Energy: 0.9465354584484303 Energy: 0.933653680418632 Energy: 0.9465354584484303 Energy: 0.933653680418632 Energy: 0.7809139520484041 Energy: 0.9464027576670869 Energy: 0.7809139520484041 Energy: 0.9464027576670869 Energy: 0.7809139520478156 Energy: 0.9464027576670869 Energy: 0.8347423859357286 Energy: 0.7584842142424102 Energy: 0.8347423859357286 Energy: 0.7584842142424102 Energy: 0.8347423859351403 Energy: 0.7584842142424102 Energy: 0.7877800624381843 Energy: 0.8153279189212406 Energy: 0.787780062437596 Energy: 0.8153279189212406 Energy: 0.7877800624381843 Energy: 0.8153279189212406 Energy: 0.7877873627441067 Energy: 0.8151281584855861 Energy: 0.7877873627446952 Energy: 0.8151281584855861 Energy: 0.7877873627441067 Energy: 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0.8347423859363169 Energy: 0.7584842142424102 Energy: 0.8347423859357286 Energy: 0.7584842142424102 Energy: 0.8347423859357286 Energy: 0.7584842142429985 Energy: 0.7877800624381843 Energy: 0.8153279189212406 Energy: 0.7877800624381843 Energy: 0.8153279189218291 Energy: 0.787780062437596 Energy: 0.8153279189212406 Energy: 0.7877873627441067 Energy: 0.8151281584849976 Energy: 0.7877873627441067 Energy: 0.8151281584849976 Energy: 0.7877873627441067 Energy: 0.8151281584849976 Energy: 0.8349171701573216 Energy: 0.7584100798698917 Energy: 0.8349171701567333 Energy: 0.7584100798698917 Energy: 0.8349171701567333 Energy: 0.7584100798698917 Energy: 0.780430157783708 Energy: 0.947199658464596 Energy: 0.780430157783708 Energy: 0.947199658464596 Energy: 0.780430157783708 Energy: 0.9471996584651844 Energy: 0.9465070663282141 Energy: 0.9335199225161362 Energy: 0.9465070663282141 Energy: 0.9335199225161362 Energy: 0.9465070663282141 Energy: 0.9335199225155478 Energy: 0.8375667572895931 Energy: 0.8038942537851633 Energy: 0.8375667572890045 Energy: 0.8038942537851633 Energy: 0.8375667572890045 Energy: 0.8038942537851633 Energy: 0.9465354584484303 Energy: 0.9336536804180435 Energy: 0.9465354584484303 Energy: 0.9336536804180435 Energy: 0.9465354584484303 Energy: 0.9336536804174552 Energy: 0.7809139520489925 Energy: 0.9464027576694406 Energy: 0.7809139520484041 Energy: 0.9464027576688521 Energy: 0.7809139520484041 Energy: 0.9464027576688521 Energy: 0.8347423859351403 Energy: 0.7584842142424102 Energy: 0.8347423859357286 Energy: 0.7584842142424102 Energy: 0.8347423859351403 Energy: 0.7584842142418218 Energy: 0.7877800624381843 Energy: 0.8153279189212406 Energy: 0.7877800624381843 Energy: 0.8153279189218291 Energy: 0.787780062437596 Energy: 0.8153279189212406 Energy: 0.7877873627441067 Energy: 0.8151281584855861 Energy: 0.7877873627441067 Energy: 0.8151281584849976 Energy: 0.7877873627446952 Energy: 0.8151281584849976 Energy: 0.8349171701573216 Energy: 0.7584100798698917 Energy: 0.8349171701579099 Energy: 0.7584100798698917 Energy: 0.8349171701579099 Energy: 0.7584100798698917 Energy: 0.780430157783708 Energy: 0.947199658464596 Energy: 0.780430157783708 Energy: 0.9471996584657727 Energy: 0.780430157783708 Energy: 0.9471996584651844 Energy: 0.9465070663282141 Energy: 0.9335199225155478 Energy: 0.9465070663282141 Energy: 0.9335199225155478 Energy: 0.9465070663282141 Energy: 0.9335199225161362 Energy: 0.8375667572895931 Energy: 0.8038942537857516 Energy: 0.8375667572895931 Energy: 0.8038942537851633 Energy: 0.8375667572895931 Energy: 0.8038942537851633 Energy: 0.9465354584478419 Energy: 0.933653680418632 Energy: 0.9465354584484303 Energy: 0.9336536804180435 Energy: 0.9465354584484303 Energy: 0.9336536804180435 Energy: 0.7809139520489925 Energy: 0.9464027576694406 Energy: 0.7809139520489925 Energy: 0.9464027576694406 Energy: 0.7809139520484041 Energy: 0.9464027576688521 minimum gb energy = 0.7584100798693034 eV minimum distance = 2.31744261485723 Angstroms sigma value = 27 ======================================== theta = 38.94244126898138 ======================================== Energy: 0.7629105773610428 Energy: 0.7215034539464005 Energy: 0.7629105773610428 Energy: 0.7215034539478418 Energy: 0.7629105773610428 Energy: 0.7215034539464005 Energy: 0.9484004610600194 Energy: 0.753390017315882 Energy: 0.9484004610600194 Energy: 0.7533900173144407 Energy: 0.9484004610600194 Energy: 0.753390017315882 Energy: 0.7079287551957593 Energy: 0.9667013781945449 Energy: 0.7079287551972006 Energy: 0.9667013781945449 Energy: 0.7079287551972006 Energy: 0.9667013781945449 Energy: 0.906242714205615 Energy: 0.7187293867286343 Energy: 0.906242714205615 Energy: 0.7187293867286343 Energy: 0.906242714205615 Energy: 0.7187293867286343 Energy: 0.9200907210467519 Energy: 0.7087703215112858 Energy: 0.9200907210467519 Energy: 0.7087703215112858 Energy: 0.9200907210467519 Energy: 0.7087703215112858 Energy: 0.7830678149275981 Energy: 0.9096382742598551 Energy: 0.7830678149275981 Energy: 0.9096382742612964 Energy: 0.7830678149275981 Energy: 0.9096382742598551 Energy: 0.7122999049971585 Energy: 0.7549045455294877 Energy: 0.7122999049971585 Energy: 0.7549045455294877 Energy: 0.7122999049971585 Energy: 0.7549045455294877 Energy: 0.7573434851836882 Energy: 0.7229171515254488 Energy: 0.7573434851836882 Energy: 0.7229171515254488 Energy: 0.7573434851822471 Energy: 0.7229171515254488 Energy: 0.8771422506623541 Energy: 0.7633556230999946 Energy: 0.8771422506637954 Energy: 0.7633556231043184 Energy: 0.8771422506637954 Energy: 0.7633556231014359 Energy: 0.9017928923902488 Energy: 0.8044885697243487 Energy: 0.9017928923902488 Energy: 0.8044885697243487 Energy: 0.9017928923902488 Energy: 0.8044885697257899 Energy: 0.746135405639907 Energy: 0.7184723866037885 Energy: 0.746135405639907 Energy: 0.7184723866023474 Energy: 0.746135405639907 Energy: 0.7184723866037885 Energy: 0.8924380237548436 Energy: 0.7717742757951634 Energy: 0.8924380237548436 Energy: 0.7717742757951634 Energy: 0.8924380237548436 Energy: 0.7717742757951634 minimum gb energy = 0.7079287551957593 eV minimum distance = 2.30247514452323 Angstroms sigma value = 9 ======================================== theta = 44.00342734889962 ======================================== Energy: 0.6664860205370957 Energy: 0.7836272080460227 Energy: 0.6664860205366908 Energy: 0.7836272080460227 Energy: 0.6664860205375006 Energy: 0.7836272080460227 Energy: 0.8981242333488078 Energy: 0.5988661307480717 Energy: 0.8981242333488078 Energy: 0.5988661307480717 Energy: 0.8981242333492127 Energy: 0.5988661307480717 Energy: 0.6048454881457873 Energy: 1.1552346981708566 Energy: 0.6048454881457873 Energy: 1.1552346981708566 Energy: 0.6048454881461923 Energy: 1.1552346981712613 Energy: 0.6292435318331518 Energy: 0.6182807014032686 Energy: 0.6292435318331518 Energy: 0.6182807014036736 Energy: 0.6292435318335567 Energy: 0.6182807014044835 Energy: 0.6558409965273444 Energy: 0.6997765792409226 Energy: 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0.7374060092659224 Energy: 1.0183110014163115 Energy: 0.7374060092659224 Energy: 1.0183110014167165 Energy: 0.7374060092655175 Energy: 1.0183110014167165 Energy: 0.9233225524966607 Energy: 0.6995313062286128 Energy: 0.9233225524974705 Energy: 0.6995313062278029 Energy: 0.9233225524982804 Energy: 0.6995313062290178 Energy: 0.6021301490455746 Energy: 0.8124338818933626 Energy: 0.6021301490463845 Energy: 0.8124338818933626 Energy: 0.6021301490459795 Energy: 0.8124338818933626 Energy: 0.6299746598303056 Energy: 0.7751443162534581 Energy: 0.6299746598307105 Energy: 0.775144316253863 Energy: 0.6299746598343551 Energy: 0.775144316253863 Energy: 0.6778932508967689 Energy: 0.8219576566449982 Energy: 0.677893250896364 Energy: 0.8219576566498575 Energy: 0.6778932508967689 Energy: 0.8219576566478328 Energy: 0.6558861678316572 Energy: 0.6995783027630035 Energy: 0.6558861678316572 Energy: 0.6995783027638134 Energy: 0.6558861678316572 Energy: 0.6995783027630035 Energy: 0.6262736536405431 Energy: 0.617111800482454 Energy: 0.6262736536405431 Energy: 0.617111800482049 Energy: 0.6262736536413531 Energy: 0.617111800482049 Energy: 0.6048286652097482 Energy: 1.1553579233653763 Energy: 0.6048286652089384 Energy: 1.1553579233653763 Energy: 0.6048286652093433 Energy: 1.1553579233653763 Energy: 0.8989486743840761 Energy: 0.7236769845571706 Energy: 0.8989486743832663 Energy: 0.7236769845563606 Energy: 0.8989486743832663 Energy: 0.7236769845563606 Energy: 0.6664860205370957 Energy: 0.7836272080472375 Energy: 0.6664860205366908 Energy: 0.7836272080468326 Energy: 0.6664860205366908 Energy: 0.7836272080472375 Energy: 0.8981242333520474 Energy: 0.598866130746047 Energy: 0.8981242333500227 Energy: 0.598866130746047 Energy: 0.8981242333496178 Energy: 0.598866130746047 Energy: 0.6048454881465972 Energy: 1.1552346981720711 Energy: 0.6048454881470021 Energy: 1.1552346981720711 Energy: 0.6048454881470021 Energy: 1.1552346981720711 Energy: 0.6292435318339618 Energy: 0.6182807014040785 Energy: 0.6292435318339618 Energy: 0.6182807014028636 Energy: 0.6292435318339618 Energy: 0.6182807014032686 Energy: 0.6558409965269394 Energy: 0.6997765792425424 Energy: 0.6558409965273444 Energy: 0.6997765792437572 Energy: 0.6558409965273444 Energy: 0.6997765792417325 minimum gb energy = 0.598866130746047 eV minimum distance = 2.38031876082185 Angstroms sigma value = 57 ======================================== theta = 50.47880364135782 ======================================== Energy: 0.3256631100761762 Energy: 0.32571667247479424 Energy: 0.23177144655294638 Energy: 0.32571667247571595 Energy: 0.3256631100761762 Energy: 0.32571667247571595 Energy: 0.9153614869860052 Energy: 0.3183817689103294 Energy: 0.9153614869860052 Energy: 0.31838176891125114 Energy: 0.915361486986927 Energy: 0.31838176891125114 Energy: 0.3623786157828355 Energy: 0.7382077587119278 Energy: 0.3623786157828355 Energy: 0.7382077587119278 Energy: 0.3623786157828355 Energy: 0.7382077587119278 Energy: 0.3265601263040703 Energy: 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0.8823650213847553 Energy: 0.27541738420158923 Energy: 0.8823650213847553 Energy: 0.27541738420158923 Energy: 0.8823650213847553 Energy: 0.32181916363064067 Energy: 0.9217146565252339 Energy: 0.32181916363064067 Energy: 0.9217146565252339 Energy: 0.32181916363064067 Energy: 0.9217146565243123 Energy: 0.3256631100761762 Energy: 0.32571667247479424 Energy: 0.23177144655386817 Energy: 0.32571667247479424 Energy: 0.3256631100752544 Energy: 0.32571667247571595 Energy: 0.915361486986927 Energy: 0.31838176891217296 Energy: 0.915361486986927 Energy: 0.31838176891125114 Energy: 0.915361486986927 Energy: 0.31838176891125114 Energy: 0.36237861578191366 Energy: 0.7382077587119278 Energy: 0.36237861578191366 Energy: 0.7382077587119278 Energy: 0.36237861578191366 Energy: 0.7382077587110061 Energy: 0.3265601263049921 Energy: 0.23152241553876424 Energy: 0.3265601263049921 Energy: 0.23152241553876424 Energy: 0.32656012630591386 Energy: 0.23152241553876424 Energy: 0.32296305546934745 Energy: 0.41498012281151 Energy: 0.3229630554684256 Energy: 0.41498012281058816 Energy: 0.32296305546934745 Energy: 0.41498012280966645 Energy: 0.2317562299959038 Energy: 1.0755620636827008 Energy: 0.2317562299959038 Energy: 1.075562063681779 Energy: 0.2317562299959038 Energy: 1.075562063681779 Energy: 0.23179168565615502 Energy: 0.2722424717051517 Energy: 0.23179168565615502 Energy: 0.2722424717051517 Energy: 0.23179168565615502 Energy: 0.2722424717051517 Energy: 0.4111584630918357 Energy: 0.32542830624705005 Energy: 0.4111584630909139 Energy: 0.32542830624705005 Energy: 0.4111584630918357 Energy: 0.32542830624705005 minimum gb energy = 0.23152241553876424 eV minimum distance = 2.45421588032348 Angstroms sigma value = 11 ======================================== theta = 55.8767054592047 ======================================== Energy: 0.556281346311353 Energy: 0.6575266724070421 Energy: 0.556281346311353 Energy: 0.6575266724070421 Energy: 0.5562813463100024 Energy: 0.6575266724070421 Energy: 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0.8183701991366126 Energy: 1.070910628997276 Energy: 0.8183701991360803 Energy: 1.0709106289978083 Energy: 0.8183701991366126 Energy: 0.5107439131770896 Energy: 0.6512629869127299 Energy: 0.5107439131770896 Energy: 0.6512629869127299 Energy: 0.5107439131770896 Energy: 0.6512629869127299 Energy: 0.5345660929869334 Energy: 0.6194524922816959 Energy: 0.5345660929869334 Energy: 0.6194524922816959 Energy: 0.5345660929869334 Energy: 0.6194524922816959 Energy: 0.4902849074956614 Energy: 0.6753771487829725 Energy: 0.4902849074956614 Energy: 0.6753771487829725 Energy: 0.4902849074956614 Energy: 0.6753771487824404 minimum gb energy = 0.4897042702720406 eV minimum distance = 2.40448197703274 Angstroms sigma value = 33 ======================================== theta = 62.439396894736774 ======================================== Energy: 0.7130505989291204 Energy: 0.5874630694630049 Energy: 0.7130505989291204 Energy: 0.5874630694618843 Energy: 0.7130505989291204 Energy: 0.5874630694618843 Energy: 0.8800356002528382 Energy: 0.5437539726670243 Energy: 0.8800356002532116 Energy: 0.5437539726673978 Energy: 0.8800356002528382 Energy: 0.5437539726670243 Energy: 0.9622123318842439 Energy: 1.0056655542880266 Energy: 0.9622123318838705 Energy: 1.0056655542663635 Energy: 0.9622123318838705 Energy: 1.0056655542626283 Energy: 0.8324825889634134 Energy: 0.5606828081070313 Energy: 0.8324825889630401 Energy: 0.5606828081077783 Energy: 0.8324825889630401 Energy: 0.5606828081070313 Energy: 0.5780935173279191 Energy: 0.9816007332169955 Energy: 0.5780935173271721 Energy: 0.9816007332173691 Energy: 0.5780935173275457 Energy: 0.9816007332173691 Energy: 0.8337817569290167 Energy: 0.5814178172222401 Energy: 0.8337817569286433 Energy: 0.5814178172222401 Energy: 0.8337817569293904 Energy: 0.5814178172218665 Energy: 0.5774578330393675 Energy: 0.6455373061297616 Energy: 0.5774578330393675 Energy: 0.645537306130135 Energy: 0.577457833039741 Energy: 0.6455373061297616 Energy: 0.6529903810460408 Energy: 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0.8334362709728067 Energy: 0.5554699784537186 Energy: 0.8334362709728067 Energy: 0.5554699784529716 Energy: 0.8334362709731802 Energy: 0.8014843123401361 Energy: 0.761963957478035 Energy: 0.8014843123405097 Energy: 0.7619639574784086 Energy: 0.8014843123405097 Energy: 0.7619639574784086 Energy: 0.5402807609408362 Energy: 0.845913369054146 Energy: 0.5402807609400893 Energy: 0.8459133690537723 Energy: 0.5402807609408362 Energy: 0.8459133690552665 minimum gb energy = 0.5399511535906851 eV minimum distance = 2.38483590822265 Angstroms sigma value = 67 ======================================== theta = 70.52877936550931 ======================================== Energy: 0.6604024227107951 Energy: 0.6260296123225608 Energy: 0.6604024227105397 Energy: 0.6260296123223339 Energy: 0.6604024227107951 Energy: 0.6260296123225608 Energy: 0.6040870667012955 Energy: 0.5869010592955823 Energy: 0.6040870667010402 Energy: 0.5869010592955823 Energy: 0.6040870667012955 Energy: 0.5869010592960929 Energy: 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======================================== Energy: 0.9604980254579772 Energy: 0.8165175407896001 Energy: 0.9604980254579772 Energy: 0.8165175407899091 Energy: 0.9604980254583478 Energy: 0.8165175407896001 Energy: 0.9015913744314408 Energy: 0.7512801567109758 Energy: 0.9015913744314408 Energy: 0.7512801567102964 Energy: 0.9015913744321201 Energy: 0.7512801567102964 Energy: 0.7760506551005637 Energy: 1.0848617043062474 Energy: 0.7760506551005637 Energy: 1.0848617043062474 Energy: 0.7760506551008726 Energy: 1.0848617043065563 Energy: 0.9588166257519571 Energy: 0.8253470870018645 Energy: 0.9588166257526366 Energy: 0.8253470870021733 Energy: 0.9588166257522661 Energy: 0.8253470870018645 Energy: 0.851552725465397 Energy: 0.873676679036078 Energy: 0.851552725465397 Energy: 0.873676679036078 Energy: 0.8515527254660764 Energy: 0.873676679036078 Energy: 0.8096165008544149 Energy: 1.0039704556758757 Energy: 0.8096165008507091 Energy: 1.0039704556762463 Energy: 0.8096165008523768 Energy: 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0.8417692379659905 Energy: 0.9339473612180559 Energy: 0.8417692379659905 Energy: 0.9339473612180559 Energy: 0.8417692379659905 Energy: 0.8503790796949399 Energy: 0.8843941351774043 Energy: 0.8503790796943672 Energy: 0.8843941351768317 Energy: 0.8503790796943672 Energy: 0.8843941351785497 Energy: 0.8830553743882192 Energy: 0.7939960461654555 Energy: 0.8830553743882192 Energy: 0.793996046166028 Energy: 0.8830553743882192 Energy: 0.7939960461654555 Energy: 0.9385741264462378 Energy: 0.8095383681130021 Energy: 0.9385741264456651 Energy: 0.8095383681130021 Energy: 0.9385741264462378 Energy: 0.8095383681130021 Energy: 0.9083542186291974 Energy: 0.9424848118988398 Energy: 0.9083542186286249 Energy: 0.9424848118988398 Energy: 0.9083542186286249 Energy: 0.9424848118988398 Energy: 0.8146849586806583 Energy: 0.9301849372494438 Energy: 0.8146849586806583 Energy: 0.9301849372545979 Energy: 0.8146849586806583 Energy: 0.9301849372551706 minimum gb energy = 0.7499308600192246 eV minimum distance = 2.32377162455688 Angstroms sigma value = 57 ======================================== theta = 86.6277133165661 ======================================== Energy: 0.905522561910026 Energy: 0.696415332379014 Energy: 0.905522561910026 Energy: 0.696415332379014 Energy: 0.905522561910026 Energy: 0.696415332379014 Energy: 0.7573718261358905 Energy: 0.870837175825095 Energy: 0.7573718261358905 Energy: 0.8708371758258363 Energy: 0.7573718261358905 Energy: 0.8708371758258363 Energy: 0.8210492334972803 Energy: 0.8647521900782236 Energy: 0.8210492334980218 Energy: 0.8647521900782236 Energy: 0.8210492334972803 Energy: 0.8647521900782236 Energy: 1.051633446306469 Energy: 0.9654071901650174 Energy: 1.0516334463057273 Energy: 0.9654071901650174 Energy: 1.0516334463049861 Energy: 0.9654071901650174 Energy: 0.7760031499053133 Energy: 0.7879245980846483 Energy: 0.7760031499053133 Energy: 0.7879245980846483 Energy: 0.7760031499053133 Energy: 0.7879245980846483 Energy: 0.8210938586665603 Energy: 0.8353975610819441 Energy: 0.8210938586665603 Energy: 0.8353975610819441 Energy: 0.8210938586665603 Energy: 0.8353975610819441 Energy: 0.906257180320876 Energy: 0.9131653431311758 Energy: 0.906257180320876 Energy: 0.9131653431311758 Energy: 0.906257180320876 Energy: 0.9131653431311758 Energy: 0.9670867202525315 Energy: 0.7616652367870669 Energy: 0.9670867202510486 Energy: 0.7616652367870669 Energy: 0.9670867202510486 Energy: 0.7616652367870669 Energy: 0.7639016045023476 Energy: 0.9504121953138482 Energy: 0.763901604501606 Energy: 0.9504121953131066 Energy: 0.7639016045023476 Energy: 0.9504121953138482 Energy: 0.6722056186992296 Energy: 0.895666247522478 Energy: 0.672205618699971 Energy: 0.8956662475209951 Energy: 0.672205618699971 Energy: 0.8956662475217364 Energy: 0.7790792288029206 Energy: 0.9519551851743164 Energy: 0.7790792288029206 Energy: 0.9519551851743164 Energy: 0.7790792288021791 Energy: 0.9519551851743164 Energy: 0.8456049960484666 Energy: 0.8702273847626683 Energy: 0.8456049960477252 Energy: 0.8702273847626683 Energy: 0.8456049960484666 Energy: 0.8702273847626683 Energy: 0.765041739050993 Energy: 0.9506199879048168 Energy: 0.765041739050993 Energy: 0.9506199879048168 Energy: 0.765041739050993 Energy: 0.9506199879048168 Energy: 0.9466611817605227 Energy: 0.891117460670463 Energy: 0.9466611817605227 Energy: 0.8911174606712046 Energy: 0.9466611817597812 Energy: 0.891117460670463 Energy: 0.9089504392125825 Energy: 0.7624216694230841 Energy: 0.9089504392118408 Energy: 0.7624216694230841 Energy: 0.9089504392125825 Energy: 0.7624216694223425 Energy: 0.9261193258199769 Energy: 0.8456842247798945 Energy: 0.9261193258199769 Energy: 0.8456842247798945 Energy: 0.9261193258207184 Energy: 0.845684224779153 Energy: 0.6723079383711333 Energy: 0.7597826378879229 Energy: 0.6723079383703918 Energy: 0.7597826378879229 Energy: 0.6723079383718749 Energy: 0.7597826378871815 Energy: 0.7767849703725311 Energy: 0.7646148019779578 Energy: 0.7767849703717897 Energy: 0.7646148019779578 Energy: 0.7767849703717897 Energy: 0.7646148019779578 Energy: 0.6723933283893274 Energy: 0.7598729093401965 Energy: 0.6723933283885858 Energy: 0.7598729093394551 Energy: 0.6723933283893274 Energy: 0.7598729093394551 Energy: 0.9262661169079781 Energy: 0.8457154252173783 Energy: 0.9262661169057537 Energy: 0.8457154252173783 Energy: 0.9262661169057537 Energy: 0.8457154252173783 Energy: 0.9089112632495306 Energy: 0.7632014534150423 Energy: 0.9089112632502722 Energy: 0.7632014534165255 Energy: 0.9089112632502722 Energy: 0.7632014534165255 Energy: 0.9465369216394495 Energy: 0.9425170043690035 Energy: 0.9465369216394495 Energy: 0.9425170043690035 Energy: 0.946536921638708 Energy: 0.9425170043690035 Energy: 0.7649105468331684 Energy: 0.9506299384791009 Energy: 0.7649105468331684 Energy: 0.9506299384783594 Energy: 0.7649105468331684 Energy: 0.9506299384783594 Energy: 0.8455835521206984 Energy: 0.8702405190683635 Energy: 0.8455835521206984 Energy: 0.8702405190683635 Energy: 0.84558355212144 Energy: 0.8702405190690714 minimum gb energy = 0.6722056186992296 eV minimum distance = 2.35119250275992 Angstroms sigma value = 17 ======================================== theta = 93.3722866834339 ======================================== Energy: 0.9819575667626692 Energy: 0.7022980604002437 Energy: 0.9819575667626692 Energy: 0.7022980604012924 Energy: 0.9819575667626692 Energy: 0.7022980604012924 Energy: 0.7852403034322997 Energy: 0.8360285380649805 Energy: 0.7852403034322997 Energy: 0.8360285380649805 Energy: 0.7852403034322997 Energy: 0.8360285380649805 Energy: 0.741257270494045 Energy: 0.8053306067600635 Energy: 0.741257270494045 Energy: 0.8053306067600635 Energy: 0.741257270494045 Energy: 0.8053306067600635 Energy: 0.8925223847791178 Energy: 0.9015911106598136 Energy: 0.8925223847791178 Energy: 0.9015911106598136 Energy: 0.8925223847791178 Energy: 0.9015911106598136 Energy: 0.7661412651612953 Energy: 0.9250173861613572 Energy: 0.7661412651602467 Energy: 0.9250173861603088 Energy: 0.7661412651602467 Energy: 0.9250173861603088 Energy: 0.8713309355273822 Energy: 0.7663232777143416 Energy: 0.8713309355273822 Energy: 0.7663232777143416 Energy: 0.8713309355273822 Energy: 0.7663232777143416 Energy: 0.7206194493623429 Energy: 0.6598601083504286 Energy: 0.7206194493633914 Energy: 0.6598601083504286 Energy: 0.7206194493633914 Energy: 0.6598601083504286 Energy: 0.7666813774257324 Energy: 0.8687219894320822 Energy: 0.7666813774267811 Energy: 0.8687219894320822 Energy: 0.7666813774257324 Energy: 0.8687219894320822 Energy: 0.7273540815693139 Energy: 0.9558515082408781 Energy: 0.7273540815693139 Energy: 0.9558515082408781 Energy: 0.7273540815693139 Energy: 0.9558515082408781 Energy: 0.8436347320841774 Energy: 0.8278305033734967 Energy: 0.8436347320841774 Energy: 0.8278305033734967 Energy: 0.8436347320841774 Energy: 0.8278305033734967 Energy: 0.8516540079440121 Energy: 0.7616706998980332 Energy: 0.8516540079440121 Energy: 0.7616706998980332 Energy: 0.8516540079440121 Energy: 0.7616706998969845 Energy: 0.7258467957006376 Energy: 0.9601075000838714 Energy: 0.7258467951870443 Energy: 0.9601075000838714 Energy: 0.7258467964322758 Energy: 0.9601075000838714 Energy: 0.6204087161782272 Energy: 0.8684601364325749 Energy: 0.6204087161782272 Energy: 0.8684601364325749 Energy: 0.6204087161782272 Energy: 0.8684601364325749 Energy: 0.7145769589373538 Energy: 0.7376910268456204 Energy: 0.7145769589363051 Energy: 0.7376910268456204 Energy: 0.7145769589373538 Energy: 0.7376910268456204 Energy: 0.7142029519138774 Energy: 0.8595320412719549 Energy: 0.7142029519138774 Energy: 0.8595320412719549 Energy: 0.7142029519138774 Energy: 0.8595320412719549 Energy: 0.7091833267080622 Energy: 0.8676995611040068 Energy: 0.7091833267091109 Energy: 0.8676995611040068 Energy: 0.7091833267080622 Energy: 0.8676995611040068 Energy: 0.7136768790955295 Energy: 0.7372431910663882 Energy: 0.7136768790955295 Energy: 0.7372431910663882 Energy: 0.7136768790955295 Energy: 0.7372431910663882 minimum gb energy = 0.6204087161782272 eV minimum distance = 2.38146978350581 Angstroms sigma value = 17 ======================================== theta = 97.054131382119 ======================================== Energy: 0.925101465474484 Energy: 0.6360914335906911 Energy: 0.925101465474484 Energy: 0.6360914335906911 Energy: 0.925101465474484 Energy: 0.6360914335902862 Energy: 0.7552359662606729 Energy: 0.7450360961984975 Energy: 0.7552359662610779 Energy: 0.7450360961984975 Energy: 0.7552359662610779 Energy: 0.7450360961984975 Energy: 0.6840547205727762 Energy: 0.7417270156009307 Energy: 0.6840547205731811 Energy: 0.7417270156009307 Energy: 0.6840547205735861 Energy: 0.7417270156009307 Energy: 0.8435311345068686 Energy: 0.6648622233248402 Energy: 0.8435311345068686 Energy: 0.6648622233248402 Energy: 0.8435311345068686 Energy: 0.6648622233244353 Energy: 0.9007888589465552 Energy: 0.7711813849059208 Energy: 0.9007888589469601 Energy: 0.7711813849063257 Energy: 0.9007888589465552 Energy: 0.7711813849059208 Energy: 0.6635327781399368 Energy: 0.6191941445696306 Energy: 0.6635327781403417 Energy: 0.6191941445696306 Energy: 0.6635327781403417 Energy: 0.6191941445696306 Energy: 0.7554997350018444 Energy: 0.7689341344495726 Energy: 0.7554997350018444 Energy: 0.7689341344499776 Energy: 0.7554997350026542 Energy: 0.7689341344499776 Energy: 0.8088555913867874 Energy: 0.8423311913798464 Energy: 0.8088555913871923 Energy: 0.8423311913802513 Energy: 0.8088555913867874 Energy: 0.8423311913802513 Energy: 0.7686743512164578 Energy: 0.687285020393272 Energy: 0.7686743512164578 Energy: 0.6872850203981314 Energy: 0.7686743512160529 Energy: 0.6872850203957017 Energy: 0.6450550077693641 Energy: 0.5741736665022905 Energy: 0.6450550077673394 Energy: 0.5741736665022905 Energy: 0.6450550077693641 Energy: 0.5741736665022905 Energy: 0.881195591052868 Energy: 0.817970597273151 Energy: 0.8811955910532732 Energy: 0.817970597273151 Energy: 0.8811955910536781 Energy: 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0.8757888824740574 Energy: 0.9053299685679865 Energy: 0.8757888824740574 Energy: 0.9053299685683914 Energy: 0.8757888824736525 Energy: 0.9053299685683914 Energy: 0.8041911519805327 Energy: 0.7558572723593978 Energy: 0.8041911519801278 Energy: 0.7558572723593978 Energy: 0.8041911519801278 Energy: 0.7558572723589928 Energy: 0.6591921957981076 Energy: 0.6526371596437504 Energy: 0.6591921957985126 Energy: 0.6526371596437504 Energy: 0.6591921957985126 Energy: 0.6526371596441553 Energy: 0.8032787239064697 Energy: 0.7559104593663216 Energy: 0.8032787239064697 Energy: 0.7559104593659166 Energy: 0.8032787239064697 Energy: 0.7559104593663216 Energy: 0.8756483588499998 Energy: 0.8636646459704146 Energy: 0.8756483588495949 Energy: 0.8636646459708195 Energy: 0.8756483588504048 Energy: 0.8636646459704146 Energy: 0.6592937483255018 Energy: 0.6565658906226031 Energy: 0.6592937483259066 Energy: 0.6565658906226031 Energy: 0.6592937483255018 Energy: 0.656565890623008 Energy: 0.7232465829277199 Energy: 0.8074046388753215 Energy: 0.7232465829273149 Energy: 0.8074046388749166 Energy: 0.7232465829281249 Energy: 0.8074046388753215 Energy: 0.7894061353584377 Energy: 0.8667162610395844 Energy: 0.7894061353596526 Energy: 0.8667162610395844 Energy: 0.7894061353608673 Energy: 0.8667162610399894 Energy: 0.7663332696822108 Energy: 0.757448153725799 Energy: 0.7663332696854502 Energy: 0.7574481537262039 Energy: 0.7663332696850453 Energy: 0.757448153725799 Energy: 0.7742275465748371 Energy: 0.7762640604959036 Energy: 0.7742275465744322 Energy: 0.7762640604959036 Energy: 0.7742275465752421 Energy: 0.7762640604959036 Energy: 0.6902955774662486 Energy: 0.9023311598622018 Energy: 0.6902955774662486 Energy: 0.9023311598617967 Energy: 0.6902955774662486 Energy: 0.9023311598622018 Energy: 0.8811535992910994 Energy: 0.8179492280873755 Energy: 0.8811535992906945 Energy: 0.8179492280877804 Energy: 0.8811535992910994 Energy: 0.8179492280873755 Energy: 0.645019166505064 Energy: 0.6907856018172115 Energy: 0.645019166504659 Energy: 0.6907856018172115 Energy: 0.645019166504254 Energy: 0.6907856018172115 Energy: 0.7691237236307061 Energy: 0.6872906000408424 Energy: 0.7691237236307061 Energy: 0.687290600043677 Energy: 0.769123723631111 Energy: 0.6872906000408424 Energy: 0.8089175438544839 Energy: 0.8423654080771209 Energy: 0.8089175438544839 Energy: 0.8423654080775259 Energy: 0.808917543854079 Energy: 0.8423654080771209 Energy: 0.755540676215849 Energy: 0.7617236670554945 Energy: 0.755540676215444 Energy: 0.7617236670554945 Energy: 0.755540676215849 Energy: 0.7617236670558994 Energy: 0.6632882669197818 Energy: 0.6294533896564084 Energy: 0.6632882669197818 Energy: 0.6294533896564084 Energy: 0.6632882669201868 Energy: 0.6294533896564084 Energy: 0.900941211376556 Energy: 0.7719241055365686 Energy: 0.900941211376556 Energy: 0.7719241055365686 Energy: 0.9009412113761511 Energy: 0.7719241055361636 Energy: 0.8434270798985847 Energy: 0.6647831765234941 Energy: 0.8434270798981798 Energy: 0.6647831765234941 Energy: 0.8434270798977748 Energy: 0.664783176523899 Energy: 0.6841560378728277 Energy: 0.7414262936261157 Energy: 0.6841560378732328 Energy: 0.7414262936265206 Energy: 0.6841560378736377 Energy: 0.7414262936257108 Energy: 0.7552601422918513 Energy: 0.7475387291697927 Energy: 0.7552601422918513 Energy: 0.7475387291697927 Energy: 0.7552601422922564 Energy: 0.7475387291697927 Energy: 0.925101465473674 Energy: 0.6360914335931208 Energy: 0.925101465473674 Energy: 0.6360914335923109 Energy: 0.925101465473674 Energy: 0.6360914335927159 Energy: 0.7552359662610779 Energy: 0.7450360961972827 Energy: 0.7552359662610779 Energy: 0.7450360961976876 Energy: 0.7552359662606729 Energy: 0.7450360961972827 Energy: 0.6840547205735861 Energy: 0.7417270156009307 Energy: 0.6840547205735861 Energy: 0.7417270156013357 Energy: 0.684054720573991 Energy: 0.7417270156009307 Energy: 0.8435311345060588 Energy: 0.6733531587654679 Energy: 0.8435311345064637 Energy: 0.6733531587654679 Energy: 0.8435311345064637 Energy: 0.6733531587658728 Energy: 0.9007888589461504 Energy: 0.7711813849067307 Energy: 0.9007888589457455 Energy: 0.7711813849071356 Energy: 0.9007888589461504 Energy: 0.7711813849071356 minimum gb energy = 0.5741736665022905 eV minimum distance = 2.32339815707386 Angstroms sigma value = 57 ======================================== theta = 99.36891557845483 ======================================== Energy: 0.8813554521159032 Energy: 0.7567598788501888 Energy: 0.8813554521159032 Energy: 0.7567598788495296 Energy: 0.8813554521159032 Energy: 0.7567598788495296 Energy: 0.6830353885450631 Energy: 0.6898226423446964 Energy: 0.6830353885463817 Energy: 0.6898226423466743 Energy: 0.6830353885463817 Energy: 0.6898226423466743 Energy: 0.6416898705095863 Energy: 0.6863560850347581 Energy: 0.6416898705089269 Energy: 0.6863560850347581 Energy: 0.6416898705089269 Energy: 0.6863560850340987 Energy: 0.8109652670388645 Energy: 0.6400610959274108 Energy: 0.8109652670395239 Energy: 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0.6708428869548534 Energy: 0.5980220092082541 Energy: 0.7989352678356629 Energy: 0.7648110295261088 Energy: 0.7989352678356629 Energy: 0.7648110295261088 Energy: 0.7989352678350038 Energy: 0.7648110295261088 Energy: 0.6036573176067519 Energy: 0.7868149751038079 Energy: 0.6036573176074113 Energy: 0.7868149751031485 Energy: 0.6036573176080706 Energy: 0.7868149751031485 Energy: 0.6704608126519231 Energy: 0.6592208089148082 Energy: 0.6704608126525825 Energy: 0.6592208089154674 Energy: 0.6704608126519231 Energy: 0.6592208089154674 Energy: 0.808379461202153 Energy: 0.7392985563221971 Energy: 0.808379461202153 Energy: 0.7392985563215378 Energy: 0.8083794612034717 Energy: 0.7392985563215378 Energy: 0.6466833463393463 Energy: 0.8610604916847955 Energy: 0.6466833463406649 Energy: 0.8610604916841362 Energy: 0.6466833463406649 Energy: 0.8610604916847955 Energy: 0.7048471869118829 Energy: 0.7101410724587706 Energy: 0.7048471869118829 Energy: 0.7101410724587706 Energy: 0.7048471869118829 Energy: 0.7101410724587706 Energy: 0.7192189652865478 Energy: 0.711206570887923 Energy: 0.7192189652852292 Energy: 0.7112065708872638 Energy: 0.7192189652858885 Energy: 0.711206570887923 Energy: 0.6270447344154874 Energy: 0.8603626169866141 Energy: 0.6270447344154874 Energy: 0.8603626169866141 Energy: 0.6270447344154874 Energy: 0.8603626169866141 Energy: 0.6942957078580672 Energy: 0.7219469056132768 Energy: 0.6942957078574077 Energy: 0.7219469056139362 Energy: 0.6942957078580672 Energy: 0.7219469056139362 Energy: 0.6790217059844305 Energy: 0.6239473552353237 Energy: 0.6790217059831118 Energy: 0.6239473552353237 Energy: 0.6790217059844305 Energy: 0.6239473552353237 Energy: 0.7129032833544877 Energy: 0.8480133454468144 Energy: 0.7129032833544877 Energy: 0.8480133454474738 Energy: 0.7129032833538284 Energy: 0.8480133454468144 Energy: 0.6380781894975208 Energy: 0.7203183315943655 Energy: 0.6380781894988395 Energy: 0.7203183315943655 Energy: 0.6380781894981802 Energy: 0.7203183315937061 Energy: 0.6051805906598069 Energy: 0.6002116621719824 Energy: 0.6051805906591475 Energy: 0.6002116621726418 Energy: 0.6051805906598069 Energy: 0.6002116621726418 Energy: 0.6222984503562857 Energy: 0.7202257768282927 Energy: 0.6222984503556264 Energy: 0.720225776826974 Energy: 0.6222984503556264 Energy: 0.7202257768282927 Energy: 0.7370125150739827 Energy: 0.8353536915353731 Energy: 0.7370125150739827 Energy: 0.8353536915353731 Energy: 0.7370125150733233 Energy: 0.8353536915360323 Energy: 0.5868817832036635 Energy: 0.6004898830611549 Energy: 0.5868817832016855 Energy: 0.6004898830604956 Energy: 0.5868817832049821 Energy: 0.6004898830604956 Energy: 0.6461367198778802 Energy: 0.7206557479233867 Energy: 0.6461367198772207 Energy: 0.7206557479233867 Energy: 0.6461367198778802 Energy: 0.7206557479233867 minimum gb energy = 0.5769107243699169 eV minimum distance = 2.33975404499672 Angstroms sigma value = 43 ======================================== theta = 102.11511746203723 ======================================== Energy: 0.8806942413317862 Energy: 0.6551908998492896 Energy: 0.8806942413317862 Energy: 0.6551908998497699 Energy: 0.8806942413322667 Energy: 0.6551908998497699 Energy: 0.6194223392772532 Energy: 0.6188047740479399 Energy: 0.6194223392772532 Energy: 0.6188047740484203 Energy: 0.6194223392762923 Energy: 0.6188047740489007 Energy: 0.558120909084727 Energy: 0.6231062889368998 Energy: 0.558120909084727 Energy: 0.6231062889349781 Energy: 0.558120909084727 Energy: 0.6231062889359389 Energy: 0.7866470153029461 Energy: 0.5540887224106844 Energy: 0.7866470153029461 Energy: 0.5540887224102039 Energy: 0.7866470153024656 Energy: 0.5540887224102039 Energy: 0.7136938456666494 Energy: 0.6627990010660515 Energy: 0.7136938456666494 Energy: 0.6627990010665319 Energy: 0.7136938456656886 Energy: 0.6627990010660515 Energy: 0.5399505902340908 Energy: 0.5825013448208065 Energy: 0.5399505902340908 Energy: 0.5825013448203261 Energy: 0.5399505902340908 Energy: 0.5825013448212869 Energy: 0.730849152930236 Energy: 0.5938469538185813 Energy: 0.7308491529297557 Energy: 0.5938469538190617 Energy: 0.730849152930236 Energy: 0.5938469538190617 Energy: 0.732261956354121 Energy: 0.6413498949999265 Energy: 0.7322619563546013 Energy: 0.6413498949999265 Energy: 0.7322619563550817 Energy: 0.6413498949999265 Energy: 0.5159149745256821 Energy: 0.5730915149090469 Energy: 0.5159149745261625 Energy: 0.5730915149095274 Energy: 0.5159149745261625 Energy: 0.5730915149090469 Energy: 0.7704565117044557 Energy: 0.5746752000507482 Energy: 0.7704565117054166 Energy: 0.5746752000497873 Energy: 0.7704565117054166 Energy: 0.5746752000507482 Energy: 0.6662451846272769 Energy: 0.6762225813911269 Energy: 0.6662451846267965 Energy: 0.6762225813911269 Energy: 0.6662451846267965 Energy: 0.6762225813916073 Energy: 0.49771258064659785 Energy: 0.5723132105267165 Energy: 0.49771258064659785 Energy: 0.5723132105267165 Energy: 0.49771258064707824 Energy: 0.5723132105267165 Energy: 0.5841860001424358 Energy: 0.4887100215256293 Energy: 0.5841860001424358 Energy: 0.48871002152659004 Energy: 0.5841860001424358 Energy: 0.48871002152659004 Energy: 0.6946378308214194 Energy: 0.6618491317604679 Energy: 0.6946378308214194 Energy: 0.6618491317604679 Energy: 0.6946378308214194 Energy: 0.6618491317604679 Energy: 0.5729527683035187 Energy: 0.7509372820516603 Energy: 0.5729527683035187 Energy: 0.7509372820511799 Energy: 0.5729527683035187 Energy: 0.7509372820511799 Energy: 0.5998875064449919 Energy: 0.5375921230775812 Energy: 0.5998875064454723 Energy: 0.5375921230775812 Energy: 0.5998875064454723 Energy: 0.5375921230780616 Energy: 0.7007803918964439 Energy: 0.6603690245615922 Energy: 0.7007803918964439 Energy: 0.6603690245615922 Energy: 0.7007803918964439 Energy: 0.6603690245615922 Energy: 0.5255573915638004 Energy: 0.7635185862982456 Energy: 0.5255573915642808 Energy: 0.763518586298726 Energy: 0.5255573915638004 Energy: 0.763518586298726 Energy: 0.5819876136398181 Energy: 0.574998213824755 Energy: 0.5819876136398181 Energy: 0.5749982138252354 Energy: 0.5819876136393377 Energy: 0.574998213824755 Energy: 0.7387252567037687 Energy: 0.6942489129792326 Energy: 0.7387252567047293 Energy: 0.6942489129792326 Energy: 0.7387252567028079 Energy: 0.6942489129792326 Energy: 0.5656000600690029 Energy: 0.8213680514273626 Energy: 0.5656000600694833 Energy: 0.8213680514273626 Energy: 0.5656000600694833 Energy: 0.8213680514273626 Energy: 0.6320876515477248 Energy: 0.6183977763854196 Energy: 0.6320876515472444 Energy: 0.6183977763849391 Energy: 0.6320876515477248 Energy: 0.6183977763849391 Energy: 0.7071313722185973 Energy: 0.6077808636017134 Energy: 0.7071313722190777 Energy: 0.6077808636017134 Energy: 0.7071313722190777 Energy: 0.6077808636017134 Energy: 0.5966748142388938 Energy: 0.8212811446603153 Energy: 0.5966748142388938 Energy: 0.8212811446603153 Energy: 0.5966748142388938 Energy: 0.8212811446603153 Energy: 0.5900783453663682 Energy: 0.6185293813443694 Energy: 0.590078345367329 Energy: 0.6185293813443694 Energy: 0.5900783453668484 Energy: 0.6185293813443694 Energy: 0.5932113738813392 Energy: 0.546365817966428 Energy: 0.5932113738813392 Energy: 0.546365817966428 Energy: 0.5932113738803784 Energy: 0.546365817966428 Energy: 0.5364323806745898 Energy: 0.7399959809173827 Energy: 0.5364323806745898 Energy: 0.7399959809169023 Energy: 0.5364323806745898 Energy: 0.7399959809169023 Energy: 0.5697680599193606 Energy: 0.5782700995749905 Energy: 0.5697680599193606 Energy: 0.5782700995740298 Energy: 0.5697680599193606 Energy: 0.5782700995749905 Energy: 0.5032589943935994 Energy: 0.5135376972971192 Energy: 0.5032589943940798 Energy: 0.5135376972971192 Energy: 0.5032589943935994 Energy: 0.5135376972971192 Energy: 0.5787424422623199 Energy: 0.6950850815731612 Energy: 0.5787424422623199 Energy: 0.6950850815731612 Energy: 0.5787424422623199 Energy: 0.6950850815736416 Energy: 0.5571210037281474 Energy: 0.7281297333550929 Energy: 0.557121003727667 Energy: 0.7281297333555733 Energy: 0.5571210037281474 Energy: 0.7281297333550929 Energy: 0.5040154877328549 Energy: 0.4987594757431768 Energy: 0.5040154877333354 Energy: 0.4987594757426964 Energy: 0.5040154877328549 Energy: 0.4987594757426964 Energy: 0.4941856315089148 Energy: 0.5959466108735718 Energy: 0.494185631507954 Energy: 0.5959466108735718 Energy: 0.4941856315084345 Energy: 0.5959466108735718 Energy: 0.6779482616909357 Energy: 0.7369579475118767 Energy: 0.6779482616914161 Energy: 0.7369579475118767 Energy: 0.6779482616909357 Energy: 0.7369579475113963 Energy: 0.5691680936978105 Energy: 0.5523124892213661 Energy: 0.5691680936978105 Energy: 0.5523124892213661 Energy: 0.5691680936978105 Energy: 0.5523124892218465 Energy: 0.5212951664896502 Energy: 0.5967755327978514 Energy: 0.5212951664901306 Energy: 0.5967755327973711 Energy: 0.5212951664901306 Energy: 0.5967755327973711 minimum gb energy = 0.4887100215256293 eV minimum distance = 2.31895349280937 Angstroms sigma value = 81 ======================================== theta = 109.47122063449069 ======================================== Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.35065991997593315 Energy: 0.025103758964802936 Energy: 0.35065991997593315 Energy: 0.025103758993044817 Energy: 0.35065991997593315 Energy: 0.025103758980688992 Energy: 0.3506679354857642 Energy: 0.024635908860442157 Energy: 0.3506679354857642 Energy: 0.02463590885867704 Energy: 0.3506679354857642 Energy: 0.024635908860442157 Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.35065991997593315 Energy: 0.02510375907243499 Energy: 0.35065991997593315 Energy: 0.025103759077730343 Energy: 0.35065991997593315 Energy: 0.025103759065374518 Energy: 0.3506679354857642 Energy: 0.024635908860442157 Energy: 0.3506679354857642 Energy: 0.024635908860442157 Energy: 0.3506679354857642 Energy: 0.024635908860442157 Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.35065991997593315 Energy: 0.025103759278853444 Energy: 0.35065991997593315 Energy: 0.025103759285913914 Energy: 0.35065991997593315 Energy: 0.02510375927355809 Energy: 0.3506679354857642 Energy: 0.024635908855146802 Energy: 0.3506679354857642 Energy: 0.02463590885867704 Energy: 0.3506679354857642 Energy: 0.02463590885691192 Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.02383858104002005 Energy: 0.05564459865960784 Energy: 0.02383858104002005 Energy: 0.05564459865960784 minimum gb energy = 0.02383858104002005 eV minimum distance = 2.53662870186472 Angstroms sigma value = 3 ======================================== theta = 117.56060310526324 ======================================== Energy: 0.763545829063936 Energy: 0.4884221260895272 Energy: 0.763545829063936 Energy: 0.4884221260895272 Energy: 0.763545829063936 Energy: 0.4884221260900553 Energy: 0.5407935112504352 Energy: 0.5115638697870334 Energy: 0.5407935112514916 Energy: 0.511563869785977 Energy: 0.5407935112504352 Energy: 0.5115638697875617 Energy: 0.545295614923758 Energy: 0.5045719679067383 Energy: 0.5452956149242862 Energy: 0.5045719679067383 Energy: 0.545295614923758 Energy: 0.5045719679067383 Energy: 0.6888967319400097 Energy: 0.5233966007778786 Energy: 0.6888967319400097 Energy: 0.5233966007778786 Energy: 0.6888967319400097 Energy: 0.5233966007778786 Energy: 0.5518675436565214 Energy: 0.5548759850445687 Energy: 0.5518675436565214 Energy: 0.5548759850466817 Energy: 0.5518675436565214 Energy: 0.5548759850419277 Energy: 0.5651125018721093 Energy: 0.553171856207085 Energy: 0.5651125018726374 Energy: 0.5531718562081415 Energy: 0.5651125018721093 Energy: 0.5531718562076132 Energy: 0.6421779342603411 Energy: 0.5770103554785982 Energy: 0.6421779342603411 Energy: 0.5770103554791265 Energy: 0.6421779342603411 Energy: 0.5770103554785982 Energy: 0.5441767632828249 Energy: 0.5535542093999065 Energy: 0.5441767632828249 Energy: 0.5535542094004349 Energy: 0.5441767632833531 Energy: 0.5535542094009629 Energy: 0.5238448297249868 Energy: 0.5760472479696687 Energy: 0.5238448297249868 Energy: 0.5760472479696687 Energy: 0.523844829725515 Energy: 0.5760472479696687 Energy: 0.6535508572313068 Energy: 0.547444084562459 Energy: 0.6535508572313068 Energy: 0.547444084562459 Energy: 0.6535508572313068 Energy: 0.547444084562459 Energy: 0.5648857745544763 Energy: 0.5539014670422552 Energy: 0.5648857745544763 Energy: 0.5539014670427834 Energy: 0.5648857745544763 Energy: 0.5539014670422552 Energy: 0.5770387363555112 Energy: 0.619796534416107 Energy: 0.5770387363555112 Energy: 0.6197965344166352 Energy: 0.5770387363555112 Energy: 0.6197965344155787 Energy: 0.6403365837546053 Energy: 0.5297637624226209 Energy: 0.6403365837540771 Energy: 0.5297637624220928 Energy: 0.6403365837551336 Energy: 0.5297637624226209 Energy: 0.49097287844694354 Energy: 0.6784121639892999 Energy: 0.49097287844694354 Energy: 0.6784121639882434 Energy: 0.49097287844694354 Energy: 0.6784121639892999 Energy: 0.5707789771069154 Energy: 0.5592031728945044 Energy: 0.5707789771074436 Energy: 0.5592031728950326 Energy: 0.5707789771074436 Energy: 0.5592031728918633 Energy: 0.6434357970710463 Energy: 0.5337917462669697 Energy: 0.6434357970715744 Energy: 0.5337917462674978 Energy: 0.6434357970715744 Energy: 0.5337917462674978 Energy: 0.4845251417571607 Energy: 0.7814761306555836 Energy: 0.4845251417571607 Energy: 0.7814761306550555 Energy: 0.4845251417576889 Energy: 0.7814761306555836 Energy: 0.5059087361603634 Energy: 0.5351126292453097 Energy: 0.5059087361608916 Energy: 0.5351126292447813 Energy: 0.5059087361603634 Energy: 0.5351126292468942 Energy: 0.585910561426249 Energy: 0.5944286303068048 Energy: 0.585910561426249 Energy: 0.5944286303062765 Energy: 0.585910561426249 Energy: 0.5944286303068048 Energy: 0.5555614465699844 Energy: 0.7131123306913799 Energy: 0.5555614465689279 Energy: 0.7131123306913799 Energy: 0.5555614465705125 Energy: 0.7131123306913799 Energy: 0.5381219697030301 Energy: 0.6075022387770954 Energy: 0.5381219697025018 Energy: 0.6075022387770954 Energy: 0.5381219697035584 Energy: 0.6075022387776235 Energy: 0.5362061709307041 Energy: 0.5498811700159116 Energy: 0.536206170930176 Energy: 0.5498811700148551 Energy: 0.5362061709312325 Energy: 0.5498811700148551 Energy: 0.5373857671064294 Energy: 0.7050600310271544 Energy: 0.5373857671064294 Energy: 0.705060031033493 Energy: 0.5373857671064294 Energy: 0.7050600310276826 Energy: 0.641899427048118 Energy: 0.5772201372210078 Energy: 0.641899427048118 Energy: 0.5772201372210078 Energy: 0.641899427048118 Energy: 0.5772201372204796 Energy: 0.6322320884492009 Energy: 0.5116882365223532 Energy: 0.6322320884492009 Energy: 0.5116882365223532 Energy: 0.6322320884492009 Energy: 0.5116882365223532 Energy: 0.5012106634799977 Energy: 0.6408619719206964 Energy: 0.5012106634799977 Energy: 0.6408619719201681 Energy: 0.5012106634799977 Energy: 0.6408619719206964 Energy: 0.5616380286215339 Energy: 0.5714877115330219 Energy: 0.5616380286210058 Energy: 0.5714877115330219 Energy: 0.5616380286215339 Energy: 0.5714877115330219 Energy: 0.6291242207494896 Energy: 0.5603867209620635 Energy: 0.6291242207494896 Energy: 0.5603867209620635 Energy: 0.6291242207494896 Energy: 0.5603867209620635 Energy: 0.48070733989294584 Energy: 0.6804516745549728 Energy: 0.48070733989294584 Energy: 0.6804516745549728 Energy: 0.48070733989294584 Energy: 0.6804516745544447 Energy: 0.5722389469317449 Energy: 0.4912448612412166 Energy: 0.5722389469322733 Energy: 0.49124486124068834 Energy: 0.5722389469312168 Energy: 0.4912448612412166 Energy: 0.5962115923350135 Energy: 0.5562696574587905 Energy: 0.5962115923344854 Energy: 0.5562696574587905 Energy: 0.5962115923350135 Energy: 0.5562696574593187 Energy: 0.5913233085545868 Energy: 0.5234112217113368 Energy: 0.5913233085545868 Energy: 0.5234112217108084 Energy: 0.5913233085545868 Energy: 0.5234112217108084 Energy: 0.5994610948846222 Energy: 0.5570718228264565 Energy: 0.5994610948846222 Energy: 0.5570718228264565 Energy: 0.5994610948846222 Energy: 0.5570718228264565 minimum gb energy = 0.48070733989294584 eV minimum distance = 2.39344005805896 Angstroms sigma value = 67 ======================================== theta = 121.00758300686714 ======================================== Energy: 0.9582460791110905 Energy: 0.6352336595504786 Energy: 0.9582460791103379 Energy: 0.6352336595504786 Energy: 0.9582460791088325 Energy: 0.6352336595504786 Energy: 0.7244093438817636 Energy: 0.6480189949796611 Energy: 0.7244093438817636 Energy: 0.6480189949789085 Energy: 0.7244093438817636 Energy: 0.6480189949796611 Energy: 0.6986654382177336 Energy: 0.6986265987578142 Energy: 0.6986654382169809 Energy: 0.6986265987578142 Energy: 0.6986654382169809 Energy: 0.6986265987585668 Energy: 0.8012130885675203 Energy: 0.6228180436806793 Energy: 0.801213088566015 Energy: 0.6228180436806793 Energy: 0.8012130885675203 Energy: 0.6228180436806793 Energy: 0.688377656783813 Energy: 0.6318002676053741 Energy: 0.688377656783813 Energy: 0.6318002676046214 Energy: 0.688377656783813 Energy: 0.6318002676046214 Energy: 0.6885732014212568 Energy: 0.7001319907513651 Energy: 0.6885732014220094 Energy: 0.7001319907521176 Energy: 0.6885732014212568 Energy: 0.7001319907506125 Energy: 0.800070513761624 Energy: 0.7035145616662882 Energy: 0.8000705137608715 Energy: 0.7035145616662882 Energy: 0.8000705137608715 Energy: 0.7035145616662882 Energy: 0.727601064238963 Energy: 0.629913015960485 Energy: 0.7276010642382104 Energy: 0.6299130159612376 Energy: 0.727601064238963 Energy: 0.6299130159612376 Energy: 0.724260658265219 Energy: 0.7407524190078489 Energy: 0.7242606582659716 Energy: 0.7407524190078489 Energy: 0.7242606582659716 Energy: 0.7407524190070962 Energy: 0.5873999358764953 Energy: 0.6930293744320966 Energy: 0.5873999358764953 Energy: 0.6930293744320966 Energy: 0.587399935877248 Energy: 0.6930293744320966 Energy: 0.6799954933008919 Energy: 0.7072138923321777 Energy: 0.6799954933001393 Energy: 0.7072138923321777 Energy: 0.6799954933008919 Energy: 0.7072138923321777 Energy: 0.6297642581232324 Energy: 0.6739890809697991 Energy: 0.6297642581239851 Energy: 0.6739890809705518 Energy: 0.6297642581232324 Energy: 0.6739890809667886 Energy: 0.6782694773909566 Energy: 0.7170654152257934 Energy: 0.6782694773917092 Energy: 0.717065415224288 Energy: 0.6782694773917092 Energy: 0.717065415224288 Energy: 0.6159470958185658 Energy: 0.7671120564510154 Energy: 0.6159470958185658 Energy: 0.767112056451768 Energy: 0.6159470958178133 Energy: 0.767112056451768 Energy: 0.648136167450087 Energy: 0.6438183561133833 Energy: 0.648136167450087 Energy: 0.6438183561126308 Energy: 0.648136167450087 Energy: 0.6438183561133833 Energy: 0.6410738568124477 Energy: 0.6692129614429564 Energy: 0.6410738568124477 Energy: 0.6692129614437089 Energy: 0.6410738568124477 Energy: 0.6692129614437089 Energy: 0.6401667876144297 Energy: 0.7679432916248559 Energy: 0.6401667876144297 Energy: 0.7679432916241034 Energy: 0.6401667876144297 Energy: 0.7679432916210926 Energy: 0.750476786666208 Energy: 0.6249137439995618 Energy: 0.750476786666208 Energy: 0.6249137440003145 Energy: 0.750476786666208 Energy: 0.6249137440003145 Energy: 0.7549213832499188 Energy: 0.7013236215388727 Energy: 0.7549213832499188 Energy: 0.7013236215388727 Energy: 0.7549213832491662 Energy: 0.7013236215388727 Energy: 0.7165223267366365 Energy: 0.8595248323050357 Energy: 0.7165223267366365 Energy: 0.8595248323057884 Energy: 0.7165223267366365 Energy: 0.8595248323057884 Energy: 0.799919122840995 Energy: 0.6299109851793578 Energy: 0.7999191228417477 Energy: 0.6299109851793578 Energy: 0.7999191228417477 Energy: 0.6299109851793578 Energy: 0.7716296926989009 Energy: 0.7317875078946832 Energy: 0.7716296926989009 Energy: 0.7317875078946832 Energy: 0.7716296926989009 Energy: 0.7317875078946832 Energy: 0.6639867499262638 Energy: 0.60516285332387 Energy: 0.6639867499262638 Energy: 0.605162853321612 Energy: 0.6639867499262638 Energy: 0.6051628533223646 minimum gb energy = 0.5873999358764953 eV minimum distance = 2.40477660041516 Angstroms sigma value = 33 ======================================== theta = 124.1232945407953 ======================================== Energy: 0.9383954136576083 Energy: 0.676363728301424 Energy: 0.9383954136576083 Energy: 0.676363728301424 Energy: 0.9383954136576083 Energy: 0.676363728301424 Energy: 0.7923027150143906 Energy: 0.739300157356138 Energy: 0.7923027150148679 Energy: 0.7393001573566154 Energy: 0.7923027150153455 Energy: 0.739300157356138 Energy: 0.7664636869588258 Energy: 0.7288088510249958 Energy: 0.7664636869588258 Energy: 0.7288088510254732 Energy: 0.7664636869583485 Energy: 0.7288088510249958 Energy: 0.8539148709867475 Energy: 0.6782733384281661 Energy: 0.8539148709872247 Energy: 0.6782733384281661 Energy: 0.8539148709862698 Energy: 0.6782733384276886 Energy: 0.7143126057364629 Energy: 0.7398363766049483 Energy: 0.7143126057359854 Energy: 0.7398363766039933 Energy: 0.7143126057359854 Energy: 0.7398363766030385 Energy: 0.8560641295582279 Energy: 0.759142261081299 Energy: 0.8560641295587053 Energy: 0.7591422610808216 Energy: 0.8560641295582279 Energy: 0.759142261081299 Energy: 0.7049675190233825 Energy: 0.6684902454856163 Energy: 0.7049675190233825 Energy: 0.6684902454851389 Energy: 0.7049675190233825 Energy: 0.6684902454837065 Energy: 0.7697157276061787 Energy: 0.765497549128301 Energy: 0.7697157276071336 Energy: 0.765497549128301 Energy: 0.769715727606656 Energy: 0.765497549128301 Energy: 0.7171512270130552 Energy: 0.7620110742294826 Energy: 0.7171512270125777 Energy: 0.7620110742299601 Energy: 0.7171512270121002 Energy: 0.7620110742299601 Energy: 0.7417932905786415 Energy: 0.7608363144906957 Energy: 0.7417932905795965 Energy: 0.7608363144906957 Energy: 0.7417932905795965 Energy: 0.7608363144906957 Energy: 0.7030420427281112 Energy: 0.8125025451770843 Energy: 0.7030420427304988 Energy: 0.8125025451770843 Energy: 0.7030420427295437 Energy: 0.8125025451770843 Energy: 0.7053132194716916 Energy: 0.7173854362913322 Energy: 0.7053132194716916 Energy: 0.7173854362913322 Energy: 0.7053132194716916 Energy: 0.7173854362913322 Energy: 0.8429240375176628 Energy: 0.680213861338876 Energy: 0.8429240375162302 Energy: 0.6802138613383985 Energy: 0.8429240375167079 Energy: 0.6802138613383985 Energy: 0.7314714346136434 Energy: 0.8083834315216794 Energy: 0.7314714346141208 Energy: 0.8083834315212017 Energy: 0.7314714346141208 Energy: 0.8083834315212017 Energy: 0.8314001688043394 Energy: 0.7363342653562429 Energy: 0.8314001688043394 Energy: 0.7363342653567204 Energy: 0.8314001688043394 Energy: 0.7363342653562429 Energy: 0.8535494533944057 Energy: 0.7805131144089211 Energy: 0.8535494533944057 Energy: 0.7805131144089211 Energy: 0.8535494533948832 Energy: 0.7805131144093986 Energy: 0.7825505000327047 Energy: 0.6991699786169091 Energy: 0.7825505000331818 Energy: 0.6991699786169091 Energy: 0.7825505000327047 Energy: 0.6991699786173866 Energy: 0.7964054046533773 Energy: 0.8365703592012755 Energy: 0.7964054046538548 Energy: 0.8365703592007981 Energy: 0.7964054046533773 Energy: 0.8365703592012755 Energy: 0.7934576861170531 Energy: 0.7855321273782611 Energy: 0.7934576861170531 Energy: 0.7855321273787383 Energy: 0.7934576861160981 Energy: 0.7855321273787383 Energy: 0.8049586412494292 Energy: 0.7383429720814182 Energy: 0.8049586412499067 Energy: 0.7383429720818957 Energy: 0.8049586412494292 Energy: 0.7383429720818957 Energy: 0.7635777425621992 Energy: 0.7814117645275368 Energy: 0.7635777425617217 Energy: 0.7814117645275368 Energy: 0.7635777425626766 Energy: 0.7814117645275368 Energy: 0.8159022251446293 Energy: 0.6911268161403121 Energy: 0.8159022251446293 Energy: 0.6911268161403121 Energy: 0.8159022251455842 Energy: 0.6911268161403121 Energy: 0.7007018496741346 Energy: 0.8125364547346358 Energy: 0.700701849674612 Energy: 0.8125364547346358 Energy: 0.700701849674612 Energy: 0.8125364547346358 Energy: 0.7739815571852431 Energy: 0.7073080424191465 Energy: 0.7739815571847656 Energy: 0.707308042419624 Energy: 0.7739815571847656 Energy: 0.707308042419624 Energy: 0.7061209522312105 Energy: 0.716539692501634 Energy: 0.7061209522312105 Energy: 0.7165396925021114 Energy: 0.706120952231688 Energy: 0.7165396925021114 Energy: 0.7013175929830033 Energy: 0.8107238420105705 Energy: 0.7013175929834807 Energy: 0.8107238420105705 Energy: 0.7013175929834807 Energy: 0.810723842010093 Energy: 0.7063483192591148 Energy: 0.6882451187090158 Energy: 0.7063483192595922 Energy: 0.6882451187090158 Energy: 0.7063483192591148 Energy: 0.6882451187085383 Energy: 0.8205520354078084 Energy: 0.8486572293978163 Energy: 0.8205520354078084 Energy: 0.8486572293982938 Energy: 0.8205520354078084 Energy: 0.8486572293978163 Energy: 0.806394962604513 Energy: 0.8991087090128219 Energy: 0.8063949626049906 Energy: 0.8991087090128219 Energy: 0.8063949626049906 Energy: 0.8991087090123445 Energy: 0.794037183210394 Energy: 0.668945773903677 Energy: 0.794037183210394 Energy: 0.6689457739041544 Energy: 0.794037183210394 Energy: 0.668945773903677 Energy: 0.8322290989786296 Energy: 0.8358263294015922 Energy: 0.8322290989781521 Energy: 0.8358263294015922 Energy: 0.8322290989781521 Energy: 0.8358263294015922 Energy: 0.7900360205500246 Energy: 0.7384755367881815 Energy: 0.7900360205500246 Energy: 0.738475536787704 Energy: 0.7900360205500246 Energy: 0.7384755367862715 Energy: 0.8595126636404354 Energy: 0.7840352131903586 Energy: 0.8595126636409128 Energy: 0.7840352131903586 Energy: 0.8595126636404354 Energy: 0.7840352131903586 Energy: 0.7452847980890337 Energy: 0.7377769934217694 Energy: 0.7452847980885562 Energy: 0.737776993421292 Energy: 0.7452847980890337 Energy: 0.7377769934208145 Energy: 0.7072108776063917 Energy: 0.7294891046435878 Energy: 0.7072108776049592 Energy: 0.7294891046435878 Energy: 0.7072108776059141 Energy: 0.7294891046431102 Energy: 0.843874845745635 Energy: 0.6781036874483602 Energy: 0.84387484574468 Energy: 0.6781036874483602 Energy: 0.843874845745635 Energy: 0.6781036874483602 Energy: 0.7115110376457009 Energy: 0.7485793952798829 Energy: 0.711511037644746 Energy: 0.7485793952798829 Energy: 0.7115110376457009 Energy: 0.7485793952798829 minimum gb energy = 0.6684902454837065 eV minimum distance = 2.34371421258908 Angstroms sigma value = 41 ======================================== theta = 129.5211963586422 ======================================== Energy: 0.878612217390415 Energy: 0.7700095649521005 Energy: 0.878612217389141 Energy: 0.7700095649507969 Energy: 0.878612217389141 Energy: 0.7700095649507969 Energy: 0.8814700366832764 Energy: 0.8107122227655446 Energy: 0.8814700366819727 Energy: 0.8107122227642409 Energy: 0.8814700366819727 Energy: 0.8107122227629372 Energy: 0.9761577134581729 Energy: 0.8403577471314748 Energy: 0.9761577134581729 Energy: 0.8403577471314748 Energy: 0.9761577134594767 Energy: 0.8403577471314748 Energy: 1.1449527269970747 Energy: 0.8830223095219171 Energy: 1.1449527269983784 Energy: 0.8830223095206136 Energy: 1.1449527269970747 Energy: 0.8830223095206136 Energy: 0.8514362149229061 Energy: 0.8111898036686659 Energy: 0.8514362149229061 Energy: 0.8111898036686659 Energy: 0.8514362149229061 Energy: 0.8111898036686659 Energy: 0.9814932110453283 Energy: 0.8716940522684119 Energy: 0.9814932110453283 Energy: 0.8716940522684119 Energy: 0.9814932110453283 Energy: 0.8716940522684119 Energy: 0.8436664870645458 Energy: 0.7894010747420739 Energy: 0.8436664870645458 Energy: 0.7894010747420739 Energy: 0.8436664870632423 Energy: 0.7894010747420739 Energy: 0.8670864177270392 Energy: 0.8557996973493154 Energy: 0.8670864177270392 Energy: 0.8557996973493154 Energy: 0.8670864177283428 Energy: 0.8557996973493154 Energy: 0.7824347199406199 Energy: 0.7905418603947085 Energy: 0.7824347199393163 Energy: 0.7905418603934048 Energy: 0.7824347199393163 Energy: 0.7905418603934048 Energy: 1.020648319260262 Energy: 0.7737994289031722 Energy: 1.020648319260262 Energy: 0.7737994289031722 Energy: 1.020648319260262 Energy: 0.7737994289031722 Energy: 0.8644734338931026 Energy: 0.8399599312126411 Energy: 0.8644734338931026 Energy: 0.8399599312126411 Energy: 0.8644734338931026 Energy: 0.8399599312126411 Energy: 0.8549771460845139 Energy: 0.82529210404702 Energy: 0.8549771460845139 Energy: 0.82529210404702 Energy: 0.8549771460845139 Energy: 0.82529210404702 Energy: 0.8558501728088221 Energy: 0.8828010960322781 Energy: 0.8558501728088221 Energy: 0.8828010960322781 Energy: 0.8558501728075184 Energy: 0.8828010960322781 Energy: 0.8487248639516436 Energy: 0.8113098563757628 Energy: 0.8487248639516436 Energy: 0.8113098563770664 Energy: 0.8487248639516436 Energy: 0.8113098563770664 minimum gb energy = 0.7700095649507969 eV minimum distance = 2.33283154314052 Angstroms sigma value = 11 ======================================== theta = 135.99657265110037 ======================================== Energy: 0.9951312706228659 Energy: 0.9501002878864135 Energy: 0.9951312706228659 Energy: 0.9501002878864135 Energy: 0.9951312706228659 Energy: 0.9501002878864135 Energy: 0.875200844044468 Energy: 0.9428079364226087 Energy: 0.8752008440450405 Energy: 0.9428079364226087 Energy: 0.8752008440456132 Energy: 0.9428079364226087 Energy: 0.9442531458364452 Energy: 0.9436438351578565 Energy: 0.9442531458370179 Energy: 0.9436438351578565 Energy: 0.9442531458370179 Energy: 0.9436438351578565 Energy: 1.034525860430085 Energy: 0.8276509782270133 Energy: 1.0345258604295122 Energy: 0.8276509782270133 Energy: 1.034525860430085 Energy: 0.8276509782270133 Energy: 0.9307851549222261 Energy: 0.9503705196613245 Energy: 0.9307851549222261 Energy: 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0.956770805799943 Energy: 0.9500358092067382 Energy: 0.956770805799943 Energy: 0.9500358092067382 Energy: 0.956770805799943 Energy: 0.9500358092061656 Energy: 0.908951726847278 Energy: 0.8787720797773486 Energy: 0.9089517268467053 Energy: 0.8787720797773486 Energy: 0.908951726847278 Energy: 0.8787720797773486 Energy: 0.8468362640238509 Energy: 0.9691401588369231 Energy: 0.8468362640238509 Energy: 0.9691401588369231 Energy: 0.8468362640238509 Energy: 0.9691401588369231 Energy: 0.8985406860169944 Energy: 0.9491901752237285 Energy: 0.8985406860169944 Energy: 0.9491901752243013 Energy: 0.8985406860175671 Energy: 0.9491901752237285 Energy: 0.9639346904947433 Energy: 0.9366873605422634 Energy: 0.9639346904947433 Energy: 0.9366873605422634 Energy: 0.9639346904941706 Energy: 0.9366873605422634 Energy: 0.881350464833049 Energy: 1.0059170916341602 Energy: 0.881350464833049 Energy: 1.0059170916335873 Energy: 0.8813504648336218 Energy: 1.0059170916341602 Energy: 0.8752227211695318 Energy: 0.8234741229055675 Energy: 0.875222721168959 Energy: 0.8234741229055675 Energy: 0.8752227211701046 Energy: 0.8234741229055675 Energy: 0.9510182702272554 Energy: 0.9678326835661505 Energy: 0.9510182702272554 Energy: 0.9678326835661505 Energy: 0.9510182702272554 Energy: 0.9678326835661505 minimum gb energy = 0.8234741229055675 eV minimum distance = 2.32909749111529 Angstroms sigma value = 57 ======================================== theta = 141.05755873101862 ======================================== Energy: 0.8703122515989332 Energy: 0.7819300847836634 Energy: 0.8703122515989332 Energy: 0.7819300847846826 Energy: 0.8703122515989332 Energy: 0.7819300847836634 Energy: 0.9200893412652968 Energy: 0.9595097466237978 Energy: 0.9200893412652968 Energy: 0.9595097466237978 Energy: 0.9200893412652968 Energy: 0.9595097466237978 Energy: 0.936196957424442 Energy: 0.883779927104464 Energy: 0.936196957424442 Energy: 0.883779927104464 Energy: 0.9361969574234228 Energy: 0.883779927104464 Energy: 0.9075720572986575 Energy: 0.9789010657573389 Energy: 0.9075720572986575 Energy: 0.9789010657563199 Energy: 0.9075720572996767 Energy: 0.9789010657563199 Energy: 0.9362043426929874 Energy: 0.8837841694266996 Energy: 0.9362043426929874 Energy: 0.8837841694266996 Energy: 0.9362043426929874 Energy: 0.8837841694266996 Energy: 0.920102336990639 Energy: 0.8942527400190206 Energy: 0.920102336990639 Energy: 0.8942527400180014 Energy: 0.920102336990639 Energy: 0.8942527400169824 Energy: 0.8703122515989332 Energy: 0.7819300847846826 Energy: 0.8703122515989332 Energy: 0.7819300847846826 Energy: 0.8703122515989332 Energy: 0.7819300847846826 Energy: 0.9200893412652968 Energy: 0.9595097466237978 Energy: 0.9200893412652968 Energy: 0.9595097466237978 Energy: 0.9200893412652968 Energy: 0.9595097466237978 Energy: 0.9361969574234228 Energy: 0.883779927104464 Energy: 0.9361969574234228 Energy: 0.883779927104464 Energy: 0.936196957424442 Energy: 0.883779927104464 Energy: 0.9075720572986575 Energy: 0.9227117121712245 Energy: 0.9075720572986575 Energy: 1.0031118888796178 Energy: 0.9075720572986575 Energy: 0.8986860183829892 Energy: 0.9362043426919682 Energy: 0.8837841694266996 Energy: 0.9362043426919682 Energy: 0.8837841694266996 Energy: 0.9362043426919682 Energy: 0.8837841694266996 Energy: 0.920102336990639 Energy: 0.8161312517005024 Energy: 0.920102336990639 Energy: 0.8161312517005024 Energy: 0.920102336990639 Energy: 0.8161312517005024 Energy: 0.870312251597914 Energy: 0.7819300847846826 Energy: 0.870312251597914 Energy: 0.7819300847846826 Energy: 0.8703122515989332 Energy: 0.7819300847846826 Energy: 0.9200893412652968 Energy: 0.9595097466237978 Energy: 0.9200893412663158 Energy: 0.9595097466237978 Energy: 0.9200893412663158 Energy: 0.9595097466237978 Energy: 0.936196957424442 Energy: 0.883779927104464 Energy: 0.936196957424442 Energy: 0.883779927104464 Energy: 0.9361969574234228 Energy: 0.883779927105483 Energy: 0.9075720572986575 Energy: 0.9227117121702053 Energy: 0.9075720572986575 Energy: 1.0406390659528977 Energy: 0.9075720572986575 Energy: 0.784414524430071 Energy: 0.9362043426929874 Energy: 0.8837841694266996 Energy: 0.9362043426929874 Energy: 0.8837841694266996 Energy: 0.9362043426929874 Energy: 0.8837841694256803 minimum gb energy = 0.7819300847836634 eV minimum distance = 2.35447883176764 Angstroms sigma value = 9 ======================================== theta = 148.41366190347208 ======================================== Energy: 0.9181817040261249 Energy: 0.9350859896851144 Energy: 0.9181817040261249 Energy: 0.9350859896851144 Energy: 0.9181817040261249 Energy: 0.9350859896851144 Energy: 0.932342611672887 Energy: 0.9946766897892849 Energy: 0.932342611672887 Energy: 0.9946766897892849 Energy: 0.9323426116720549 Energy: 0.9946766897901169 Energy: 0.9039528469236765 Energy: 0.9289449949405607 Energy: 0.9039528469236765 Energy: 0.9289449949405607 Energy: 0.9039528469236765 Energy: 0.9289449949405607 Energy: 0.9267069516478418 Energy: 1.0133046529278436 Energy: 0.9267069516478418 Energy: 1.0133046529278436 Energy: 0.9267069516478418 Energy: 1.0133046529278436 Energy: 1.0755348705670063 Energy: 0.9368482730149026 Energy: 1.0755348705670063 Energy: 0.9368482730149026 Energy: 1.0755348705670063 Energy: 0.9368482730149026 Energy: 1.0072940472634215 Energy: 0.9102453976959781 Energy: 1.0072940472634215 Energy: 0.9102453976959781 Energy: 1.0072940472634215 Energy: 0.9102453976959781 Energy: 0.9014319497363303 Energy: 0.9054101298306588 Energy: 0.9014319497363303 Energy: 0.9054101298306588 Energy: 0.9014319497354983 Energy: 0.9054101298298268 Energy: 1.0217227524445434 Energy: 0.8955866652749578 Energy: 1.0217227524445434 Energy: 0.8955866652757899 Energy: 1.0217227524445434 Energy: 0.8955866652757899 Energy: 1.01154336496201 Energy: 0.9666841687235002 Energy: 1.01154336496201 Energy: 0.9666841687226682 Energy: 1.01154336496201 Energy: 0.9666841687235002 Energy: 0.9007311187145564 Energy: 0.8986940094107913 Energy: 0.9007311187145564 Energy: 0.8986940094107913 Energy: 0.9007311187145564 Energy: 0.8986940094107913 Energy: 0.8584050066844677 Energy: 0.9259325833707931 Energy: 0.8584050066852997 Energy: 0.9259325833707931 Energy: 0.8584050066836357 Energy: 0.925932583369961 Energy: 0.9290126095811135 Energy: 0.9111469389013109 Energy: 0.9290126095811135 Energy: 0.9111469389013109 Energy: 0.9290126095811135 Energy: 0.9111469389013109 Energy: 0.9381168868474298 Energy: 1.0650838012384058 Energy: 0.9381168868474298 Energy: 1.0650838012384058 Energy: 0.9381168868465977 Energy: 1.0650838012384058 Energy: 0.8957109651895263 Energy: 0.8984950931955907 Energy: 0.8957109651903584 Energy: 0.8984950931947587 Energy: 0.8957109651903584 Energy: 0.8984950931955907 Energy: 0.9111732046509087 Energy: 0.9388858453418536 Energy: 0.9111732046517407 Energy: 0.9388858453418536 Energy: 0.9111732046509087 Energy: 0.9388858453418536 Energy: 0.9175225865267453 Energy: 0.9156297647399412 Energy: 0.9175225865267453 Energy: 0.9156297647416054 Energy: 0.9175225865267453 Energy: 0.9156297647399412 Energy: 0.951102560966457 Energy: 0.915679495239261 Energy: 0.951102560965625 Energy: 0.915679495239261 Energy: 0.951102560966457 Energy: 0.915679495239261 Energy: 0.997608484910379 Energy: 0.9372867616815744 Energy: 0.997608484910379 Energy: 0.9372867616815744 Energy: 0.9976084849112111 Energy: 0.9372867616807423 Energy: 0.8865970012153105 Energy: 0.90180519818557 Energy: 0.8865970012153105 Energy: 0.901805198186402 Energy: 0.9060922446560207 Energy: 0.90180519818557 Energy: 1.0301899089086832 Energy: 0.8911859564959601 Energy: 1.0301899089095152 Energy: 0.8911859564959601 Energy: 1.0301899089086832 Energy: 0.8911859564959601 Energy: 0.9237737709179432 Energy: 0.909760417494146 Energy: 0.9237737709179432 Energy: 0.9097604174949784 Energy: 0.9237737709179432 Energy: 0.9097604174949784 minimum gb energy = 0.8584050066836357 eV minimum distance = 2.34338909340175 Angstroms sigma value = 27 ======================================== theta = 153.4746479833903 ======================================== Energy: 0.9312148324444575 Energy: 1.1093413234323484 Energy: 0.931214832445159 Energy: 1.1093413234316472 Energy: 0.9312148324444575 Energy: 1.1093413234316472 Energy: 0.8732993851607107 Energy: 0.8892720207798758 Energy: 0.8732993851614123 Energy: 0.8892720207798758 Energy: 0.8732993851614123 Energy: 0.8892720207798758 Energy: 0.8354610847085188 Energy: 0.8514694007990058 Energy: 0.8354610847078173 Energy: 0.8514694007990058 Energy: 0.8354610847085188 Energy: 0.8514694007990058 Energy: 0.8429932221509463 Energy: 0.8611845480752601 Energy: 0.8429932221509463 Energy: 0.8611845480752601 Energy: 0.8429932221509463 Energy: 0.8611845480752601 Energy: 0.8890046493912143 Energy: 0.8604184508672386 Energy: 0.8890046493919157 Energy: 0.8604184508672386 Energy: 0.8890046493912143 Energy: 0.8604184508672386 Energy: 1.0043158461049606 Energy: 0.9201926962590834 Energy: 1.0043158461049606 Energy: 0.9201926962625903 Energy: 1.0043158461049606 Energy: 0.9201926962597846 Energy: 0.8910807747687988 Energy: 0.8729478533742745 Energy: 0.8910807747687988 Energy: 0.8729478533756772 Energy: 0.8910807747687988 Energy: 0.8729478533749759 Energy: 0.9108068023715439 Energy: 0.8394545861938527 Energy: 0.9108068023715439 Energy: 0.8394545861938527 Energy: 0.9108068023715439 Energy: 0.8394545861931513 Energy: 0.8593854000250425 Energy: 0.8471382904491074 Energy: 0.8593854000257439 Energy: 0.8471382904491074 Energy: 0.8593854000250425 Energy: 0.8471382904491074 Energy: 0.9351496716364486 Energy: 1.0536625960476085 Energy: 0.9351496716350459 Energy: 1.0536625960483097 Energy: 0.9351496716357474 Energy: 1.0536625960476085 Energy: 0.9348025856895301 Energy: 0.9487174721163266 Energy: 0.9348025856888288 Energy: 0.9487174721142224 Energy: 0.9348025856888288 Energy: 0.9487174721219378 Energy: 0.8799554431938535 Energy: 0.8638929851324925 Energy: 0.8799554431938535 Energy: 0.8638929851324925 Energy: 0.879955443193152 Energy: 0.8638929851324925 Energy: 0.8392375983885209 Energy: 0.867273802729797 Energy: 0.8392375983885209 Energy: 0.8672738027290956 Energy: 0.8392375983885209 Energy: 0.8672738027290956 Energy: 0.8436735074560116 Energy: 0.8479589114421661 Energy: 0.8436735074567129 Energy: 0.8479589114428675 Energy: 0.8436735074560116 Energy: 0.8479589114421661 Energy: 1.004393547297269 Energy: 0.9187684331565644 Energy: 1.004393547298672 Energy: 0.918768433157266 Energy: 1.0043935472979704 Energy: 0.9187684331565644 Energy: 0.8883412211114871 Energy: 0.9168422356484597 Energy: 0.8883412211121884 Energy: 0.9168422356484597 Energy: 0.8883412211121884 Energy: 0.9168422356484597 Energy: 0.8638113149131142 Energy: 0.8351086172117468 Energy: 0.8638113149131142 Energy: 0.8351086172117468 Energy: 0.8638113149131142 Energy: 0.8351086172117468 Energy: 0.861306274385714 Energy: 0.8528151309403225 Energy: 0.8613062743850127 Energy: 0.852815130939621 Energy: 0.8613062743850127 Energy: 0.852815130939621 Energy: 0.8098355687384436 Energy: 0.8902653045436167 Energy: 0.8098355739137839 Energy: 0.8902653045436167 Energy: 0.8098355655765929 Energy: 0.8902653045436167 Energy: 0.9312148324444575 Energy: 1.1093413234323484 Energy: 0.931214832445159 Energy: 1.1093413234323484 Energy: 0.9312148324444575 Energy: 1.1093413234323484 Energy: 0.8732993851614123 Energy: 0.8892720207791743 Energy: 0.8732993851614123 Energy: 0.8892720207798758 Energy: 0.8732993851607107 Energy: 0.8892720207798758 Energy: 0.8354610847085188 Energy: 0.8514694007990058 Energy: 0.8354610847092202 Energy: 0.8514694007990058 Energy: 0.8354610847078173 Energy: 0.8514694007997072 Energy: 0.8429932221502449 Energy: 0.8611845480745587 Energy: 0.8429932221509463 Energy: 0.8611845480745587 Energy: 0.8429932221502449 Energy: 0.8611845480745587 Energy: 0.8890046493919157 Energy: 0.8604184508686414 Energy: 0.8890046493919157 Energy: 0.86041845086794 Energy: 0.8890046493919157 Energy: 0.8604184508693428 Energy: 1.0043158461056618 Energy: 0.9201926962597846 Energy: 1.0043158461049606 Energy: 0.9201926962597846 Energy: 1.0043158461049606 Energy: 0.9201926962590834 minimum gb energy = 0.8098355655765929 eV minimum distance = 2.35046955306389 Angstroms sigma value = 19 ======================================== theta = 157.15649268207542 ======================================== Energy: 0.8601022014032496 Energy: 0.9478745763838323 Energy: 0.8601022014032496 Energy: 0.9478745763838323 Energy: 0.8601022014038551 Energy: 0.9478745763838323 Energy: 0.8912890840679828 Energy: 0.8873208087205503 Energy: 0.8912890840679828 Energy: 0.8873208087199449 Energy: 0.8912890840679828 Energy: 0.8873208087205503 Energy: 1.0167314084747243 Energy: 0.8347324044711834 Energy: 1.0167314084753298 Energy: 0.834732404471789 Energy: 1.0167314084747243 Energy: 0.834732404471789 Energy: 0.8273215843127829 Energy: 0.9501269441090268 Energy: 0.8273215843127829 Energy: 0.9501269441090268 Energy: 0.8273215843133883 Energy: 0.9501269441096324 Energy: 0.8746010095116487 Energy: 0.9057676663712407 Energy: 0.8746010095116487 Energy: 0.9057676663712407 Energy: 0.8746010095116487 Energy: 0.9057676663712407 Energy: 0.8987768797027873 Energy: 0.8322675035131151 Energy: 0.898776879702182 Energy: 0.8322675035125098 Energy: 0.898776879702182 Energy: 0.8322675035131151 Energy: 0.8307757881498333 Energy: 0.9814597751976372 Energy: 0.8307757881498333 Energy: 0.9814597751976372 Energy: 0.830775788149228 Energy: 0.9814597751994535 Energy: 0.8510609822413288 Energy: 0.9791449328074122 Energy: 0.8510609822413288 Energy: 0.9791449328074122 Energy: 0.8510609822413288 Energy: 0.9791449328074122 Energy: 0.8898619755474343 Energy: 0.8137266170784895 Energy: 0.8898619755474343 Energy: 0.8137266170790951 Energy: 0.8898619755474343 Energy: 0.8137266170784895 Energy: 0.9197887087315314 Energy: 0.8859116353888035 Energy: 0.919788708732137 Energy: 0.8859116353881981 Energy: 0.919788708732137 Energy: 0.8859116353881981 Energy: 0.8203084804391437 Energy: 0.984833816518705 Energy: 0.8203084804391437 Energy: 0.9848338165180996 Energy: 0.8203084804391437 Energy: 0.984833816518705 Energy: 0.9462219730304468 Energy: 0.8317810132434468 Energy: 0.9462219730237869 Energy: 0.8317810132440522 Energy: 0.9462219730262086 Energy: 0.8317810132434468 Energy: 1.0125467997747493 Energy: 0.8735217163711171 Energy: 1.0125467997747493 Energy: 0.8735217163711171 Energy: 1.0125467997747493 Energy: 0.8735217163711171 Energy: 0.8312372801787261 Energy: 0.882554809145283 Energy: 0.8312372801787261 Energy: 0.882554809145283 Energy: 0.8312372801781208 Energy: 0.882554809145283 Energy: 0.9345202351365304 Energy: 0.8644620376950393 Energy: 0.934520235137136 Energy: 0.8644620376950393 Energy: 0.934520235137136 Energy: 0.8644620376950393 Energy: 0.9947546594298821 Energy: 0.8138507084281823 Energy: 0.9947546594298821 Energy: 0.8138507084281823 Energy: 0.9947546594298821 Energy: 0.8138507084281823 Energy: 0.8378764690230864 Energy: 0.9462211875138952 Energy: 0.8378764690236917 Energy: 0.9462211875132899 Energy: 0.8378764690236917 Energy: 0.9462211875138952 Energy: 0.9368066057569697 Energy: 0.9858350933298438 Energy: 0.9368066057563641 Energy: 0.9858350933298438 Energy: 0.9368066057569697 Energy: 0.9858350933298438 Energy: 0.9081000719654617 Energy: 0.8308040339625686 Energy: 0.9081000719654617 Energy: 0.8308040339625686 Energy: 0.9081000719654617 Energy: 0.8308040339625686 Energy: 0.838012199975006 Energy: 0.909607166639124 Energy: 0.838012199975006 Energy: 0.9096071666397295 Energy: 0.8380121999744005 Energy: 0.909607166639124 Energy: 0.8098844539178092 Energy: 1.0254194595872583 Energy: 0.8098844539178092 Energy: 1.0254194595866528 Energy: 0.8098844539172035 Energy: 1.0254194595872583 Energy: 0.9502744518653504 Energy: 0.8343066301734093 Energy: 0.9502744518653504 Energy: 0.8343066301734093 Energy: 0.9502744518653504 Energy: 0.8343066301734093 Energy: 0.9567957103362903 Energy: 0.9550482983654548 Energy: 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0.8307654604893384 Energy: 1.0093894862117383 Energy: 0.8307654604893384 minimum gb energy = 0.8098844539172035 eV minimum distance = 2.3393891286077 Angstroms sigma value = 101 ======================================== theta = 159.95002427584853 ======================================== Energy: 0.8112018243544631 Energy: 0.8935553800048155 Energy: 0.8112018243539308 Energy: 0.8935553800048155 Energy: 0.8112018243544631 Energy: 0.8935553800048155 Energy: 0.9521255872275635 Energy: 0.8389670475958596 Energy: 0.9521255872280957 Energy: 0.8389670475969241 Energy: 0.9521255872275635 Energy: 0.838967047596392 Energy: 0.9098929502025168 Energy: 0.7980018443614083 Energy: 0.9098929502030491 Energy: 0.7980018443624728 Energy: 0.9098929502030491 Energy: 0.7980018443614083 Energy: 0.7736728066017178 Energy: 1.06826627989438 Energy: 0.7736728066017178 Energy: 1.06826627989438 Energy: 0.7736728066022501 Energy: 1.06826627989438 Energy: 0.9001292686536403 Energy: 0.8682650350112187 Energy: 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0.7852090306123476 Energy: 0.7737271729561216 Energy: 0.8500015632748957 Energy: 0.7737271729561216 Energy: 0.8500015632748957 Energy: 0.7737271729561216 Energy: 0.8500015632748957 Energy: 0.9716610156193274 Energy: 0.7959861916752576 Energy: 0.9716610156182629 Energy: 0.7959861916752576 Energy: 0.9716610156193274 Energy: 0.7959861916752576 Energy: 0.944133425700618 Energy: 0.8002479325148254 Energy: 0.944133425700618 Energy: 0.8002479325142932 Energy: 0.9441334257000858 Energy: 0.8002479325142932 Energy: 0.81111500343958 Energy: 1.0242707380742757 Energy: 0.81111500343958 Energy: 1.0242707380742757 Energy: 0.81111500343958 Energy: 1.0242707380742757 Energy: 0.8723631517917841 Energy: 0.9590243161041434 Energy: 0.8723631517923165 Energy: 0.9590243161036113 Energy: 0.8723631517917841 Energy: 0.959024316103079 Energy: 0.8476301048182856 Energy: 0.7979806944895326 Energy: 0.8476301048182856 Energy: 0.7979806944895326 Energy: 0.8476301048182856 Energy: 0.7979806944895326 Energy: 0.7727934018912647 Energy: 0.8657667838975759 Energy: 0.7727934018907325 Energy: 0.8657667838986401 Energy: 0.7727934018907325 Energy: 0.8657667838975759 Energy: 0.772768276478716 Energy: 0.9080414865180955 Energy: 0.7727682764792482 Energy: 0.9080414865175632 Energy: 0.772768276478716 Energy: 0.9080414865175632 Energy: 0.9104377074428364 Energy: 0.7852287308378068 Energy: 0.9104377074428364 Energy: 0.7852287308378068 Energy: 0.9104377074423041 Energy: 0.7852287308383389 Energy: 1.0651061806190674 Energy: 0.7851096739523258 Energy: 1.0651061806185351 Energy: 0.7851096739523258 Energy: 1.0651061806185351 Energy: 0.7851096739517935 minimum gb energy = 0.7726827429050881 eV minimum distance = 2.35700777333672 Angstroms sigma value = 33 ======================================== theta = 180.0 ======================================== Energy: 0.01543972414861938 Energy: 0.7354531999657608 Energy: 0.01543972414861938 Energy: 0.7354531999657608 Energy: 0.01543972414861938 Energy: 0.7354531999653432 Energy: 0.01688730430175609 Energy: 1.1580191141587501 Energy: 0.01688730430175609 Energy: 1.1580191141591676 Energy: 0.01688730430175609 Energy: 1.158019114158308 Energy: 0.8829900258779401 Energy: 0.25824361382097805 Energy: 0.8829900258779401 Energy: 0.25824361382097805 Energy: 0.8829900258783822 Energy: 0.25824361382097805 Energy: 0.01688730430175609 Energy: 1.1580191141578657 Energy: 0.01688730430175609 Energy: 1.1580191141587501 Energy: 0.01688730430175609 Energy: 1.1580191141591676 minimum gb energy = 0.01543972414861938 eV minimum distance = 2.52026776509898 Angstroms sigma value = 1