Number of particles = 900 A = 1 Angstrom (basic length-scale) H0(1,1) = 38.7047 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 77.3741 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.63132 A .NO_VELOCITY. entry_count = 7 auxiliary[0] = id auxiliary[1] = v_mass_metal auxiliary[2] = v_csym_metal auxiliary[3] = v_particle_eng_metal 63.546000 Cu 0.0248328 0.0412477 0 479 63.546 0.000552587 -3.42012 63.546000 Cu 0.0292781 0.00783728 2.46261e-16 482 63.546 0.00882412 -3.41994 63.546000 Cu 0.0959119 0.0080139 3.08124e-17 483 63.546 0.00782826 -3.41779 63.546000 Cu 0.0603943 0.0246957 0.5 484 63.546 0.00139655 -3.41931 63.546000 Cu 0.0912835 0.0417082 1.19428e-19 504 63.546 0.0023365 -3.41876 63.546000 Cu 0.157366 0.0426107 6.95071e-17 505 63.546 0.0357931 -3.41552 63.546000 Cu 0.126746 0.0251244 0.5 506 63.546 0.00626692 -3.41634 63.546000 Cu 0.162217 0.00845578 1.13337e-16 508 63.546 0.0357617 -3.41209 63.546000 Cu 0.192691 0.0263793 0.5 510 63.546 0.152667 -3.41044 63.546000 Cu 0.228122 0.0110702 0 509 63.546 0.35424 -3.38796 63.546000 Cu 0.223076 0.0457342 3.08124e-17 538 63.546 0.0919356 -3.41315 63.546000 Cu 0.288632 0.0521195 8.47939e-18 539 63.546 0.0933376 -3.40545 63.546000 Cu 0.257658 0.0320138 0.5 540 63.546 0.056036 -3.38867 63.546000 Cu 0.292508 0.0199453 1.37103e-16 542 63.546 0.449981 -3.36596 63.546000 Cu 0.32891 0.00633414 0.5 544 63.546 0.409578 -3.40721 63.546000 Cu 0.324326 0.0382584 0.5 545 63.546 0.160507 -3.41327 63.546000 Cu 0.360001 0.0230705 1.19428e-19 543 63.546 0.0396877 -3.41608 63.546000 Cu 0.395895 0.00721915 0.5 546 63.546 0.0156655 -3.41908 63.546000 Cu 0.391368 0.0399137 0.5 582 63.546 0.00814216 -3.42011 63.546000 Cu 0.427082 0.0238317 1.91682e-16 584 63.546 0.00350719 -3.42067 63.546000 Cu 0.493806 0.0241647 1.21936e-16 585 63.546 0.00181617 -3.42051 63.546000 Cu 0.462562 0.00743841 0.5 586 63.546 0.00955858 -3.42047 63.546000 Cu 0.458253 0.0405723 0.5 587 63.546 0.00114604 -3.42089 63.546000 Cu 0.529205 0.00762192 0.5 588 63.546 0.0089292 -3.42031 63.546000 Cu 0.524871 0.0410412 0.5 632 63.546 0.000687324 -3.42044 63.546000 Cu 0.560342 0.0245521 0 634 63.546 0.0013179 -3.41978 63.546000 Cu 0.62667 0.025118 1.03902e-17 635 63.546 0.00478687 -3.41682 63.546000 Cu 0.595815 0.00796198 0.5 636 63.546 0.00717726 -3.41829 63.546000 Cu 0.591255 0.0416335 0.5 637 63.546 0.00176127 -3.41914 63.546000 Cu 0.662141 0.00847588 0.5 638 63.546 0.0323797 -3.41252 63.546000 Cu 0.657331 0.0426099 0.5 690 63.546 0.0324138 -3.41583 63.546000 Cu 0.692633 0.026379 1.19428e-19 692 63.546 0.147849 -3.41071 63.546000 Cu 0.757599 0.0319527 1.19428e-19 693 63.546 0.057305 -3.38903 63.546000 Cu 0.728069 0.0110337 0.5 694 63.546 0.355603 -3.38927 63.546000 Cu 0.723029 0.0456944 0.5 695 63.546 0.0921031 -3.41348 63.546000 Cu 0.788574 0.0520386 0.5 458 63.546 0.0884985 -3.4053 63.546000 Cu 0.828932 0.00628914 3.08124e-17 455 63.546 0.400993 -3.40643 63.546000 Cu 0.792482 0.0198727 0.5 456 63.546 0.442255 -3.36577 63.546000 Cu 0.824285 0.038192 1.09515e-16 460 63.546 0.152297 -3.41306 63.546000 Cu 0.859975 0.0230538 0.5 462 63.546 0.0372362 -3.41586 63.546000 Cu 0.891307 0.039959 3.08124e-17 461 63.546 0.00772176 -3.42023 63.546000 Cu 0.895927 0.00727308 1.00797e-16 464 63.546 0.0151263 -3.41922 63.546000 Cu 0.962617 0.00762949 5.26677e-17 465 63.546 0.00991806 -3.42078 63.546000 Cu 0.927058 0.0239575 0.5 466 63.546 0.00363742 -3.421 63.546000 Cu 0.958168 0.0407606 9.44675e-17 478 63.546 0.00141966 -3.42099 63.546000 Cu 0.993802 0.0243935 0.5 480 63.546 0.00186414 -3.42041 63.546000 Cu 0.0202035 0.0746217 3.08124e-17 500 63.546 0.000523203 -3.42062 63.546000 Cu 0.0866315 0.0753622 1.95862e-17 501 63.546 0.00247323 -3.42007 63.546000 Cu 0.0557699 0.0582161 0.5 502 63.546 0.000929846 -3.42003 63.546000 Cu 0.051095 0.0917091 0.5 503 63.546 0.00073585 -3.42074 63.546000 Cu 0.12204 0.058983 0.5 507 63.546 0.00811671 -3.41853 63.546000 Cu 0.11741 0.092739 0.5 532 63.546 0.0083671 -3.4202 63.546000 Cu 0.152763 0.0766167 1.21936e-16 534 63.546 0.0288632 -3.41924 63.546000 Cu 0.21856 0.0798497 1.21817e-16 535 63.546 0.0284485 -3.4171 63.546000 Cu 0.18802 0.0607799 0.5 536 63.546 0.0763574 -3.4177 63.546000 Cu 0.183432 0.0948316 0.5 537 63.546 0.0360976 -3.42072 63.546000 Cu 0.253519 0.0656867 0.5 541 63.546 0.0147028 -3.4109 63.546000 Cu 0.249273 0.0990676 0.5 574 63.546 0.00493297 -3.41749 63.546000 Cu 0.284534 0.0848639 1.95504e-16 576 63.546 0.0278103 -3.41602 63.546000 Cu 0.320069 0.0705435 0.5 578 63.546 0.0577724 -3.41658 63.546000 Cu 0.315673 0.103175 0.5 579 63.546 0.024326 -3.41911 63.546000 Cu 0.351296 0.0881828 4.26e-16 577 63.546 0.0227363 -3.41915 63.546000 Cu 0.355748 0.0555826 2.42439e-16 580 63.546 0.0376599 -3.41649 63.546000 Cu 0.42262 0.0567832 2.01953e-16 581 63.546 0.00310346 -3.42064 63.546000 Cu 0.386928 0.072677 0.5 583 63.546 0.00914145 -3.41997 63.546000 Cu 0.418043 0.0897542 3.08124e-17 626 63.546 0.00320823 -3.42138 63.546000 Cu 0.453704 0.0737101 0.5 628 63.546 0.00128592 -3.42113 63.546000 Cu 0.484687 0.0907206 0 627 63.546 0.000508766 -3.42121 63.546000 Cu 0.489324 0.0574509 4.95626e-17 630 63.546 0.000597019 -3.42081 63.546000 Cu 0.520293 0.0744434 0.5 633 63.546 0.00047877 -3.42078 63.546000 Cu 0.551164 0.0915577 0 684 63.546 0.000857378 -3.42084 63.546000 Cu 0.555808 0.0580704 8.1211e-18 631 63.546 0.000840476 -3.42023 63.546000 Cu 0.617429 0.0926625 3.08124e-17 685 63.546 0.00773554 -3.42031 63.546000 Cu 0.586663 0.0752509 0.5 686 63.546 0.00250889 -3.42019 63.546000 Cu 0.622046 0.058938 1.19428e-19 688 63.546 0.0071532 -3.41871 63.546000 Cu 0.652748 0.076584 0.5 691 63.546 0.0260525 -3.41934 63.546000 Cu 0.687973 0.0607642 3.08124e-17 689 63.546 0.0716593 -3.41799 63.546000 Cu 0.683406 0.0947907 3.08124e-17 746 63.546 0.0336513 -3.42077 63.546000 Cu 0.749214 0.0989889 3.08124e-17 747 63.546 0.00453597 -3.41767 63.546000 Cu 0.718523 0.0797954 0.5 748 63.546 0.027976 -3.41747 63.546000 Cu 0.753484 0.0656095 1 750 63.546 0.0140868 -3.41106 63.546000 Cu 0.784469 0.0847767 0.5 459 63.546 0.024982 -3.41589 63.546000 Cu 0.819986 0.070477 1.39253e-16 457 63.546 0.0536089 -3.41648 63.546000 Cu 0.855674 0.0555594 0.5 463 63.546 0.0348574 -3.41661 63.546000 Cu 0.815576 0.103115 3.08124e-17 470 63.546 0.0213501 -3.41909 63.546000 Cu 0.851185 0.0881643 0.5 472 63.546 0.0206823 -3.41936 63.546000 Cu 0.886827 0.0727236 0 474 63.546 0.00890261 -3.42028 63.546000 Cu 0.953573 0.0738845 4.58603e-17 475 63.546 0.00174955 -3.42116 63.546000 Cu 0.92251 0.0569025 0.5 476 63.546 0.00339232 -3.42084 63.546000 Cu 0.917902 0.0898813 0.5 477 63.546 0.00402306 -3.42161 63.546000 Cu 0.989213 0.0576614 0.5 481 63.546 0.00078117 -3.42066 63.546000 Cu 0.984565 0.0908954 0.5 498 63.546 0.000620968 -3.42107 63.546000 Cu 0.0154923 0.107966 3.58284e-19 497 63.546 0.00026715 -3.42113 63.546000 Cu 0.0772093 0.142426 3.08124e-17 527 63.546 0.00216986 -3.4215 63.546000 Cu 0.0463679 0.125134 0.5 528 63.546 0.00060833 -3.42127 63.546000 Cu 0.0819303 0.108937 1.19428e-19 530 63.546 0.00234174 -3.42089 63.546000 Cu 0.010751 0.141291 3.08124e-17 526 63.546 0.00012781 -3.42146 63.546000 Cu 0.112714 0.126369 0.5 533 63.546 0.00722327 -3.42133 63.546000 Cu 0.148131 0.110438 1.02589e-16 531 63.546 0.0199314 -3.42125 63.546000 Cu 0.143451 0.144089 3.08124e-17 568 63.546 0.0131306 -3.42221 63.546000 Cu 0.209507 0.147069 3.6545e-16 569 63.546 0.00494092 -3.42152 63.546000 Cu 0.178806 0.128592 0.5 570 63.546 0.017935 -3.42202 63.546000 Cu 0.214073 0.113569 4.09638e-17 572 63.546 0.0106889 -3.42027 63.546000 Cu 0.280192 0.117783 1.67319e-16 573 63.546 0.0101503 -3.41914 63.546000 Cu 0.244826 0.132327 0.5 575 63.546 0.00176449 -3.42014 63.546000 Cu 0.275721 0.150796 0 618 63.546 0.00397992 -3.42068 63.546000 Cu 0.311189 0.135995 0.5 620 63.546 0.0111601 -3.42047 63.546000 Cu 0.382396 0.105521 0.5 624 63.546 0.00777216 -3.42098 63.546000 Cu 0.342164 0.153847 3.08124e-17 619 63.546 0.00793062 -3.42155 63.546000 Cu 0.34676 0.120945 5.4698e-17 622 63.546 0.0132372 -3.42067 63.546000 Cu 0.413382 0.122776 0 623 63.546 0.00307664 -3.42181 63.546000 Cu 0.37774 0.13846 0.5 625 63.546 0.00627291 -3.42175 63.546000 Cu 0.408685 0.155862 3.08124e-17 676 63.546 0.0031858 -3.42222 63.546000 Cu 0.444323 0.140012 0.5 678 63.546 0.00147487 -3.42196 63.546000 Cu 0.44903 0.106853 0.5 629 63.546 0.00141586 -3.42152 63.546000 Cu 0.47521 0.157229 1.97534e-16 677 63.546 0.000420811 -3.42171 63.546000 Cu 0.479949 0.123981 3.08124e-17 680 63.546 0.000487884 -3.4215 63.546000 Cu 0.546427 0.124995 5.06375e-17 681 63.546 0.000746146 -3.42133 63.546000 Cu 0.515584 0.107808 0.5 682 63.546 0.000272222 -3.42117 63.546000 Cu 0.510832 0.141147 0.5 683 63.546 0.000143022 -3.42148 63.546000 Cu 0.581977 0.10882 0.5 687 63.546 0.00247092 -3.42096 63.546000 Cu 0.577248 0.142312 0.5 740 63.546 0.0023539 -3.42157 63.546000 Cu 0.612718 0.126286 3.08124e-17 742 63.546 0.00680873 -3.42144 63.546000 Cu 0.648126 0.110381 0.5 744 63.546 0.0185474 -3.42128 63.546000 Cu 0.643452 0.14403 0.5 745 63.546 0.0117675 -3.4222 63.546000 Cu 0.775651 0.150756 0.5 469 63.546 0.00328989 -3.42072 63.546000 Cu 0.678787 0.128538 1 743 63.546 0.0170091 -3.42195 63.546000 Cu 0.714021 0.113512 0.5 749 63.546 0.0103439 -3.42028 63.546000 Cu 0.709482 0.147002 0.5 794 63.546 0.00533988 -3.42136 63.546000 Cu 0.74476 0.132266 1.21936e-16 796 63.546 0.00154808 -3.42005 63.546000 Cu 0.882248 0.105588 3.08124e-17 471 63.546 0.00812562 -3.42129 63.546000 Cu 0.780124 0.117714 0.5 468 63.546 0.00858004 -3.41929 63.546000 Cu 0.8111 0.13597 3.08124e-17 467 63.546 0.00978831 -3.42068 63.546000 Cu 0.846637 0.120955 0.5 473 63.546 0.0123541 -3.42089 63.546000 Cu 0.842067 0.153896 0.5 490 63.546 0.00812079 -3.42175 63.546000 Cu 0.877617 0.138544 1 492 63.546 0.00673128 -3.42192 63.546000 Cu 0.944208 0.140165 1 493 63.546 0.00199823 -3.42188 63.546000 Cu 0.91324 0.122909 0.5 494 63.546 0.00403872 -3.42195 63.546000 Cu 0.908568 0.155991 0.5 495 63.546 0.00370406 -3.42215 63.546000 Cu 0.948886 0.107015 1.45105e-16 496 63.546 0.00196525 -3.4216 63.546000 Cu 0.979849 0.124135 0.5 499 63.546 0.000583163 -3.42152 63.546000 Cu 0.975113 0.157379 0.5 524 63.546 0.000578442 -3.4217 63.546000 Cu 0.041612 0.158513 0.5 529 63.546 0.000523967 -3.42158 63.546000 Cu 0.0677995 0.209195 3.58284e-19 561 63.546 0.00183147 -3.42213 63.546000 Cu 0.0368911 0.191866 0.5 562 63.546 0.000376809 -3.42186 63.546000 Cu 0.0724385 0.175842 2.79462e-17 564 63.546 0.00191371 -3.42187 63.546000 Cu 0.107992 0.15989 0.5 566 63.546 0.00580422 -3.42199 63.546000 Cu 0.103293 0.193312 0.5 567 63.546 0.00468017 -3.42245 63.546000 Cu 0.00600022 0.174602 0 523 63.546 7.6784e-05 -3.42176 63.546000 Cu 0.00132882 0.207904 3.75004e-17 560 63.546 3.10152e-05 -3.42182 63.546000 Cu 0.138752 0.17759 3.08124e-17 565 63.546 0.00907964 -3.42266 63.546000 Cu 0.174168 0.162154 0.5 571 63.546 0.0098781 -3.42246 63.546000 Cu 0.169553 0.195558 0.5 612 63.546 0.00677218 -3.42252 63.546000 Cu 0.204908 0.180427 3.08124e-17 614 63.546 0.0032338 -3.42192 63.546000 Cu 0.271172 0.183882 1.38059e-16 615 63.546 0.00171323 -3.42144 63.546000 Cu 0.240307 0.165552 0.5 616 63.546 0.00052778 -3.42127 63.546000 Cu 0.235763 0.198747 0.5 617 63.546 0.00023769 -3.42143 63.546000 Cu 0.306641 0.168961 0.5 621 63.546 0.00588184 -3.42145 63.546000 Cu 0.302086 0.202032 0.5 670 63.546 0.00355057 -3.42184 63.546000 Cu 0.337547 0.186881 3.08124e-17 672 63.546 0.00556601 -3.42219 63.546000 Cu 0.403991 0.189021 0 673 63.546 0.00332304 -3.42247 63.546000 Cu 0.373108 0.171494 0.5 674 63.546 0.00496128 -3.42225 63.546000 Cu 0.368464 0.204632 0.5 675 63.546 0.00462604 -3.42264 63.546000 Cu 0.439573 0.173208 0.5 679 63.546 0.00171636 -3.42212 63.546000 Cu 0.434897 0.206442 0.5 732 63.546 0.00184302 -3.42227 63.546000 Cu 0.470464 0.190495 9.42287e-17 734 63.546 0.00048758 -3.42193 63.546000 Cu 0.536929 0.191725 1.72932e-16 735 63.546 0.000588617 -3.42186 63.546000 Cu 0.506065 0.174454 0.5 736 63.546 6.50852e-05 -3.42167 63.546000 Cu 0.501363 0.207756 0.5 737 63.546 1.97482e-05 -3.42187 63.546000 Cu 0.541674 0.15838 2.07208e-16 738 63.546 0.00066014 -3.42156 63.546000 Cu 0.608003 0.159802 1 739 63.546 0.00554598 -3.42196 63.546000 Cu 0.572463 0.175731 0.5 741 63.546 0.00198939 -3.42186 63.546000 Cu 0.567805 0.209081 0.5 786 63.546 0.00188656 -3.42218 63.546000 Cu 0.603278 0.19323 2.69907e-17 788 63.546 0.00418788 -3.42239 63.546000 Cu 0.638729 0.177523 0.5 790 63.546 0.00840505 -3.42261 63.546000 Cu 0.669529 0.195497 3.08124e-17 789 63.546 0.00681656 -3.42259 63.546000 Cu 0.674135 0.16209 8.09722e-17 792 63.546 0.00969242 -3.42244 63.546000 Cu 0.77111 0.183871 0.5 486 63.546 0.00150616 -3.42123 63.546000 Cu 0.740263 0.165501 1.19428e-19 793 63.546 0.000451702 -3.42112 63.546000 Cu 0.704885 0.180365 0.5 795 63.546 0.00366489 -3.42195 63.546000 Cu 0.735745 0.198714 0 834 63.546 0.000291957 -3.42136 63.546000 Cu 0.802049 0.202072 3.08124e-17 485 63.546 0.00321854 -3.4217 63.546000 Cu 0.806554 0.168977 1.19428e-19 488 63.546 0.00552469 -3.42152 63.546000 Cu 0.872996 0.171603 0 489 63.546 0.00583724 -3.4224 63.546000 Cu 0.837467 0.186961 0.5 491 63.546 0.006048 -3.42226 63.546000 Cu 0.868388 0.204775 1.57167e-16 518 63.546 0.00628508 -3.42267 63.546000 Cu 0.934844 0.206567 1.15845e-17 519 63.546 0.00145839 -3.42229 63.546000 Cu 0.903903 0.189153 0.5 520 63.546 0.00370835 -3.42251 63.546000 Cu 0.939472 0.173343 1.21936e-16 522 63.546 0.0017659 -3.42202 63.546000 Cu 0.970401 0.190639 0.5 525 63.546 0.000564323 -3.42194 63.546000 Cu 0.0322437 0.225174 0.5 563 63.546 0.000327927 -3.42188 63.546000 Cu 0.0275375 0.258451 0.5 604 63.546 0.000404909 -3.42184 63.546000 Cu 0.0631335 0.242491 0 606 63.546 0.00159998 -3.42207 63.546000 Cu 0.0986694 0.226651 0.5 608 63.546 0.00368933 -3.42251 63.546000 Cu 0.093994 0.259908 0.5 609 63.546 0.00316862 -3.42238 63.546000 Cu 0.129531 0.244254 0 607 63.546 0.00534465 -3.42266 63.546000 Cu 0.13416 0.210981 0 610 63.546 0.00633852 -3.42278 63.546000 Cu 0.20042 0.213685 0 611 63.546 0.00298729 -3.4219 63.546000 Cu 0.165014 0.228838 0.5 613 63.546 0.00587191 -3.42261 63.546000 Cu 0.195892 0.246865 3.08124e-17 664 63.546 0.0033915 -3.42196 63.546000 Cu 0.160404 0.262017 0.5 662 63.546 0.00620996 -3.42233 63.546000 Cu 0.231326 0.231903 0.5 666 63.546 0.000368271 -3.42144 63.546000 Cu 0.262212 0.250147 3.08124e-17 665 63.546 0.000256054 -3.42147 63.546000 Cu 0.266698 0.217006 3.08124e-17 668 63.546 0.00072242 -3.42145 63.546000 Cu 0.333035 0.220023 5.26677e-17 669 63.546 0.00467325 -3.42246 63.546000 Cu 0.297614 0.235182 0.5 671 63.546 0.00257244 -3.42197 63.546000 Cu 0.328479 0.253278 3.58284e-19 726 63.546 0.0054208 -3.42252 63.546000 Cu 0.394763 0.255568 3.08124e-17 727 63.546 0.00453065 -3.42256 63.546000 Cu 0.363906 0.237881 0.5 728 63.546 0.00544404 -3.42271 63.546000 Cu 0.399369 0.222253 3.08124e-17 730 63.546 0.00378692 -3.42254 63.546000 Cu 0.430242 0.239726 0.5 733 63.546 0.00201817 -3.42218 63.546000 Cu 0.465806 0.223767 5.01598e-17 731 63.546 0.000394248 -3.42189 63.546000 Cu 0.461163 0.257079 1.59675e-16 780 63.546 0.000540019 -3.42198 63.546000 Cu 0.527652 0.258333 3.08124e-17 781 63.546 0.000405571 -3.42208 63.546000 Cu 0.49669 0.241053 0.5 782 63.546 4.49041e-05 -3.42188 63.546000 Cu 0.532241 0.225046 0 784 63.546 0.000403459 -3.42193 63.546000 Cu 0.563137 0.242385 0.5 787 63.546 0.00165125 -3.42227 63.546000 Cu 0.598663 0.226559 1.0856e-16 785 63.546 0.00373409 -3.42253 63.546000 Cu 0.634151 0.210907 0.5 791 63.546 0.00629691 -3.4227 63.546000 Cu 0.594127 0.259816 1.19428e-19 826 63.546 0.00327569 -3.42254 63.546000 Cu 0.629555 0.244177 0.5 828 63.546 0.00568666 -3.42263 63.546000 Cu 0.664999 0.228788 4.8846e-17 830 63.546 0.00568854 -3.42245 63.546000 Cu 0.660561 0.261965 3.08124e-17 827 63.546 0.00646642 -3.42225 63.546000 Cu 0.76668 0.217011 0.5 487 63.546 0.000426136 -3.42139 63.546000 Cu 0.762233 0.25018 0.5 513 63.546 0.000193801 -3.42138 63.546000 Cu 0.731299 0.231888 0 831 63.546 0.000534525 -3.42151 63.546000 Cu 0.700394 0.213645 0.5 832 63.546 0.00308003 -3.42196 63.546000 Cu 0.695906 0.246831 0.5 833 63.546 0.00377302 -3.42179 63.546000 Cu 0.797585 0.235261 1.21697e-16 514 63.546 0.00276627 -3.42194 63.546000 Cu 0.86387 0.238037 1.21697e-16 515 63.546 0.00665163 -3.42271 63.546000 Cu 0.832978 0.220137 0.5 516 63.546 0.00555335 -3.42244 63.546000 Cu 0.828468 0.253422 0.5 517 63.546 0.00666067 -3.42249 63.546000 Cu 0.899306 0.2224 0.5 521 63.546 0.00425879 -3.4226 63.546000 Cu 0.894721 0.255734 0.5 554 63.546 0.00509329 -3.42232 63.546000 Cu 0.930204 0.239871 1.18353e-16 556 63.546 0.00196544 -3.42223 63.546000 Cu 0.996664 0.241187 2.43514e-16 557 63.546 2.03421e-05 -3.42181 63.546000 Cu 0.965756 0.223909 0.5 558 63.546 0.000438939 -3.42201 63.546000 Cu 0.961067 0.257221 0.5 559 63.546 0.000546149 -3.42182 63.546000 Cu 0.0584333 0.275737 0 603 63.546 0.00177991 -3.42213 63.546000 Cu 0.0229265 0.291725 0.5 605 63.546 0.000726832 -3.42202 63.546000 Cu 0.0540581 0.308939 0 656 63.546 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-3.41077 63.546000 Cu 0.242281 0.416817 1.19428e-19 806 63.546 0.0555509 -3.38977 63.546000 Cu 0.276737 0.403034 0.5 808 63.546 0.084062 -3.41308 63.546000 Cu 0.311611 0.387959 3.08124e-17 810 63.546 0.0680188 -3.41783 63.546000 Cu 0.342468 0.406142 0.5 813 63.546 0.0335859 -3.416 63.546000 Cu 0.377564 0.389811 3.55895e-17 811 63.546 0.00772494 -3.41897 63.546000 Cu 0.34662 0.372148 0.5 812 63.546 0.0267047 -3.4195 63.546000 Cu 0.412727 0.373475 0.5 817 63.546 0.0021556 -3.42056 63.546000 Cu 0.408512 0.40712 0.5 845 63.546 0.00194843 -3.41939 63.546000 Cu 0.443792 0.390665 1.21936e-16 847 63.546 0.000798377 -3.42071 63.546000 Cu 0.510277 0.391329 1.46896e-16 848 63.546 0.000546838 -3.42127 63.546000 Cu 0.479112 0.374309 0.5 849 63.546 0.000359181 -3.42141 63.546000 Cu 0.474893 0.407693 0.5 850 63.546 0.0005813 -3.42079 63.546000 Cu 0.545702 0.375102 0.5 854 63.546 0.00151329 -3.42158 63.546000 Cu 0.54152 0.408228 0.5 874 63.546 0.00112346 -3.42139 63.546000 Cu 0.576983 0.392081 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0.908549 0.40736 1.17159e-16 645 63.546 0.00216533 -3.41929 63.546000 Cu 0.912814 0.37372 3.08124e-17 648 63.546 0.00240606 -3.42052 63.546000 Cu 0.979245 0.3745 9.96029e-17 649 63.546 0.000351257 -3.42123 63.546000 Cu 0.943894 0.390875 0.5 651 63.546 0.000766235 -3.42057 63.546000 Cu 0.975001 0.407876 2.42797e-16 706 63.546 0.000507807 -3.42074 63.546000 Cu 0.0374394 0.441475 3.08124e-17 756 63.546 0.00884961 -3.42076 63.546000 Cu 0.104102 0.441791 0 757 63.546 0.0139228 -3.41913 63.546000 Cu 0.0729169 0.425156 0.5 758 63.546 0.00264436 -3.42096 63.546000 Cu 0.0691262 0.458116 0.5 759 63.546 0.0305243 -3.42089 63.546000 Cu 0.00616711 0.424748 0.5 709 63.546 0.00124545 -3.42059 63.546000 Cu 0.00256003 0.458021 0.5 754 63.546 0.0260872 -3.42184 63.546000 Cu 0.139979 0.425979 0.5 763 63.546 0.0353862 -3.4161 63.546000 Cu 0.135444 0.458373 0.5 800 63.546 0.0626744 -3.41495 63.546000 Cu 0.17106 0.44268 0 802 63.546 0.390477 -3.40657 63.546000 Cu 0.207475 0.429014 0.5 804 63.546 0.435592 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0.00810701 -3.42082 63.546000 Cu 0.572783 0.425026 1 873 63.546 0.00313306 -3.4212 63.546000 Cu 0.56902 0.457992 9.2079e-17 890 63.546 0.0295885 -3.42103 63.546000 Cu 0.635371 0.458275 3.08124e-17 891 63.546 0.0643534 -3.41491 63.546000 Cu 0.604005 0.441699 0.5 892 63.546 0.0140866 -3.41929 63.546000 Cu 0.639881 0.425907 3.08124e-17 894 63.546 0.0377125 -3.41586 63.546000 Cu 0.671025 0.442663 0.5 897 63.546 0.404024 -3.40653 63.546000 Cu 0.737764 0.451246 0.5 183 63.546 5.60055 -3.2366 63.546000 Cu 0.701731 0.459694 1.22055e-16 408 63.546 5.43229 -3.12494 63.546000 Cu 0.771832 0.437943 3.08124e-17 640 63.546 0.353603 -3.38885 63.546000 Cu 0.707409 0.429073 3.08124e-17 895 63.546 0.450495 -3.36438 63.546000 Cu 0.807187 0.422625 0.5 642 63.546 0.15008 -3.41064 63.546000 Cu 0.873213 0.423911 0.5 647 63.546 0.00588861 -3.41682 63.546000 Cu 0.837799 0.440547 1.36626e-16 641 63.546 0.0341144 -3.41256 63.546000 Cu 0.801837 0.457348 0.5 643 63.546 0.32152 -3.39096 63.546000 Cu 0.86861 0.457788 0.5 700 63.546 0.0482263 -3.41561 63.546000 Cu 0.904142 0.441039 1.21817e-16 702 63.546 0.00637558 -3.41808 63.546000 Cu 0.97078 0.441285 1.93473e-17 703 63.546 0.00744772 -3.42026 63.546000 Cu 0.939573 0.424401 0.5 704 63.546 0.00102533 -3.41975 63.546000 Cu 0.93568 0.45792 0.5 705 63.546 0.0315359 -3.42101 63.546000 Cu 0.0376809 0.507786 9.91252e-18 3 63.546 0.00959604 -3.42059 63.546000 Cu 0.0732902 0.524086 0.5 7 63.546 0.00319071 -3.42087 63.546000 Cu 0.0065669 0.524556 0.5 16 63.546 0.00161371 -3.42033 63.546000 Cu 0.0352931 0.474644 1.4606e-16 753 63.546 0.040511 -3.42257 63.546000 Cu 0.069275 0.491134 0.5 797 63.546 0.02917 -3.42086 63.546000 Cu 0.101686 0.474595 1.06769e-16 798 63.546 0.0519248 -3.42275 63.546000 Cu 0.104357 0.507396 1.24802e-16 4 63.546 0.013814 -3.41899 63.546000 Cu 0.00268195 0.491278 0.5 755 63.546 0.0265944 -3.42167 63.546000 Cu 0.171289 0.506372 3.08124e-17 1 63.546 0.399823 -3.40701 63.546000 Cu 0.20776 0.519929 0.5 2 63.546 0.440729 -3.3665 63.546000 Cu 0.140315 0.523173 0.5 6 63.546 0.0389155 -3.41602 63.546000 Cu 0.168379 0.474525 3.08124e-17 799 63.546 3.36552 -3.33722 63.546000 Cu 0.135596 0.490793 0.5 801 63.546 0.0618618 -3.41483 63.546000 Cu 0.201902 0.489298 0.5 835 63.546 5.42598 -3.12677 63.546000 Cu 0.264281 0.474376 0.5 838 63.546 4.42181 -3.3865 63.546000 Cu 0.237943 0.497782 1.84039e-16 836 63.546 5.63088 -3.23664 63.546000 Cu 0.272107 0.511005 0.5 185 63.546 0.363853 -3.38819 63.546000 Cu 0.301909 0.491579 3.08124e-17 837 63.546 0.340277 -3.39011 63.546000 Cu 0.333508 0.474363 0.5 842 63.546 0.193831 -3.40306 63.546000 Cu 0.401249 0.474413 0.5 867 63.546 0.0722797 -3.42284 63.546000 Cu 0.404296 0.508019 0.5 134 63.546 0.00680263 -3.41781 63.546000 Cu 0.337962 0.508417 0.5 135 63.546 0.0366663 -3.41205 63.546000 Cu 0.368663 0.491223 1.22055e-16 865 63.546 0.0480191 -3.41509 63.546000 Cu 0.435732 0.491161 0 866 63.546 0.0308377 -3.42068 63.546000 Cu 0.373523 0.525121 4.45466e-17 133 63.546 0.00525241 -3.41626 63.546000 Cu 0.439864 0.524682 0 136 63.546 0.00131023 -3.41919 63.546000 Cu 0.468429 0.474463 0.5 871 63.546 0.0447214 -3.423 63.546000 Cu 0.506452 0.524374 3.08124e-17 91 63.546 0.00174126 -3.42024 63.546000 Cu 0.537588 0.507646 0.5 92 63.546 0.00933332 -3.42031 63.546000 Cu 0.470912 0.507836 0.5 93 63.546 0.00823126 -3.41973 63.546000 Cu 0.502549 0.491106 0 887 63.546 0.0272533 -3.42152 63.546000 Cu 0.535164 0.474495 0.5 889 63.546 0.0412263 -3.42251 63.546000 Cu 0.56912 0.490999 1.4833e-16 888 63.546 0.0322937 -3.42076 63.546000 Cu 0.64033 0.52308 0 57 63.546 0.0363586 -3.41595 63.546000 Cu 0.604288 0.50729 0.5 59 63.546 0.014418 -3.41887 63.546000 Cu 0.573228 0.523957 1.19428e-19 94 63.546 0.00329027 -3.42069 63.546000 Cu 0.635519 0.490705 1.27071e-16 453 63.546 0.0629806 -3.41484 63.546000 Cu 0.601608 0.474505 0.5 893 63.546 0.0507916 -3.4229 63.546000 Cu 0.764316 0.474543 0 639 63.546 4.39246 -3.38849 63.546000 Cu 0.668295 0.474495 0.5 410 63.546 3.34348 -3.3374 63.546000 Cu 0.737968 0.497868 0.5 31 63.546 5.62158 -3.23937 63.546000 Cu 0.671295 0.506335 0.5 58 63.546 0.394616 -3.40671 63.546000 Cu 0.707817 0.519946 4.51438e-17 60 63.546 0.437327 -3.36814 63.546000 Cu 0.701859 0.489316 3.08124e-17 451 63.546 5.42776 -3.12787 63.546000 Cu 0.772185 0.511172 1.22055e-16 696 63.546 0.358189 -3.38879 63.546000 Cu 0.833588 0.474613 3.08124e-17 698 63.546 0.191044 -3.40312 63.546000 Cu 0.838103 0.508674 3.08124e-17 32 63.546 0.0332809 -3.41219 63.546000 Cu 0.801985 0.491811 0.5 697 63.546 0.329154 -3.38979 63.546000 Cu 0.868754 0.491479 0.5 701 63.546 0.0480829 -3.41505 63.546000 Cu 0.873656 0.525359 0.5 34 63.546 0.00497023 -3.41645 63.546000 Cu 0.901334 0.474648 1.19428e-19 699 63.546 0.0710731 -3.42276 63.546000 Cu 0.968529 0.474647 1.19428e-19 752 63.546 0.0446241 -3.42306 63.546000 Cu 0.904406 0.508251 4.04861e-17 13 63.546 0.00665084 -3.41772 63.546000 Cu 0.971033 0.508021 1.21936e-16 14 63.546 0.00798374 -3.41991 63.546000 Cu 0.935805 0.49137 0.5 751 63.546 0.0320078 -3.42078 63.546000 Cu 0.939982 0.524905 0.5 17 63.546 0.00122344 -3.4194 63.546000 Cu 0.0422235 0.540912 1.60989e-16 18 63.546 0.00139859 -3.42096 63.546000 Cu 0.0468158 0.574023 1.21578e-16 19 63.546 0.00175188 -3.42116 63.546000 Cu 0.0778792 0.557033 0.5 20 63.546 0.00321026 -3.42081 63.546000 Cu 0.0112266 0.55782 0.5 21 63.546 0.000736908 -3.42072 63.546000 Cu 0.109017 0.540078 0 5 63.546 0.00762205 -3.42018 63.546000 Cu 0.176041 0.538289 3.08124e-17 8 63.546 0.156062 -3.41312 63.546000 Cu 0.180339 0.570564 1.13934e-16 9 63.546 0.0553499 -3.41607 63.546000 Cu 0.144684 0.555675 0.5 11 63.546 0.0361678 -3.41668 63.546000 Cu 0.113531 0.57284 1.21578e-16 22 63.546 0.0088604 -3.42025 63.546000 Cu 0.211747 0.552104 0.5 10 63.546 0.0914923 -3.40497 63.546000 Cu 0.24265 0.531972 3.65211e-16 184 63.546 0.0563466 -3.38844 63.546000 Cu 0.307539 0.526316 1.19428e-19 186 63.546 0.157785 -3.41048 63.546000 Cu 0.312338 0.560716 3.08124e-17 187 63.546 0.0772801 -3.41794 63.546000 Cu 0.27723 0.545656 0.5 189 63.546 0.097492 -3.41339 63.546000 Cu 0.246846 0.565615 1 241 63.546 0.0148152 -3.4105 63.546000 Cu 0.409002 0.541712 0.5 139 63.546 0.00192379 -3.4189 63.546000 Cu 0.342935 0.542554 0.5 188 63.546 0.0377535 -3.41545 63.546000 Cu 0.378272 0.558969 1.69588e-17 190 63.546 0.00755648 -3.41842 63.546000 Cu 0.413781 0.575342 0.5 192 63.546 0.0019772 -3.42007 63.546000 Cu 0.34759 0.576557 0.5 193 63.546 0.02949 -3.4193 63.546000 Cu 0.542158 0.540757 0.5 97 63.546 0.00145021 -3.42079 63.546000 Cu 0.44457 0.558207 3.58284e-19 137 63.546 0.000871526 -3.41994 63.546000 Cu 0.475461 0.541247 0.5 138 63.546 0.000717253 -3.42018 63.546000 Cu 0.511142 0.557627 3.08124e-17 140 63.546 0.000579705 -3.42061 63.546000 Cu 0.480204 0.5746 0.5 143 63.546 0.000380097 -3.42062 63.546000 Cu 0.546832 0.573866 0.5 142 63.546 0.00189342 -3.42103 63.546000 Cu 0.577883 0.556887 0 95 63.546 0.00302061 -3.42069 63.546000 Cu 0.609064 0.539968 0.5 96 63.546 0.00729309 -3.42009 63.546000 Cu 0.644752 0.555585 3.08124e-17 98 63.546 0.0338094 -3.41654 63.546000 Cu 0.613585 0.572727 0.5 101 63.546 0.00863356 -3.42005 63.546000 Cu 0.711829 0.552133 1 61 63.546 0.0899009 -3.40592 63.546000 Cu 0.74273 0.532075 0.5 62 63.546 0.0557547 -3.39028 63.546000 Cu 0.676088 0.53825 0.5 63 63.546 0.151801 -3.41315 63.546000 Cu 0.746965 0.565712 0.5 67 63.546 0.0144401 -3.41158 63.546000 Cu 0.680448 0.570526 0.5 100 63.546 0.0531081 -3.41631 63.546000 Cu 0.777376 0.545829 1 64 63.546 0.093063 -3.41394 63.546000 Cu 0.843073 0.542803 3.08124e-17 33 63.546 0.0342285 -3.41559 63.546000 Cu 0.807684 0.526542 0.5 35 63.546 0.150416 -3.41067 63.546000 Cu 0.812494 0.560917 0.5 66 63.546 0.0744265 -3.41813 63.546000 Cu 0.878414 0.559193 0.5 39 63.546 0.00723775 -3.41848 63.546000 Cu 0.847751 0.576792 1.48568e-16 68 63.546 0.0265626 -3.41932 63.546000 Cu 0.975578 0.541425 1.08799e-16 15 63.546 0.000511716 -3.42025 63.546000 Cu 0.909144 0.541946 0 36 63.546 0.0016132 -3.41885 63.546000 Cu 0.913856 0.575562 1.21817e-16 37 63.546 0.00200255 -3.42001 63.546000 Cu 0.944681 0.558421 0.5 38 63.546 0.000690921 -3.42021 63.546000 Cu 0.980244 0.574797 0 40 63.546 0.000460912 -3.42078 63.546000 Cu 0.0824647 0.589993 0.5 25 63.546 0.00352805 -3.42157 63.546000 Cu 0.0158491 0.59105 0.5 42 63.546 0.000675736 -3.42122 63.546000 Cu 0.051436 0.607137 6.78351e-17 44 63.546 0.00179094 -3.42176 63.546000 Cu 0.0870451 0.623006 0.5 46 63.546 0.00377702 -3.42188 63.546000 Cu 0.0204877 0.62429 0.5 47 63.546 0.000844588 -3.42153 63.546000 Cu 0.118027 0.60569 1.21458e-16 23 63.546 0.00862317 -3.4212 63.546000 Cu 0.149154 0.588278 0.5 24 63.546 0.022856 -3.41918 63.546000 Cu 0.184736 0.603182 2.43514e-16 26 63.546 0.0224748 -3.4187 63.546000 Cu 0.153626 0.621021 0.5 29 63.546 0.0129371 -3.42068 63.546000 Cu 0.215843 0.584818 0.5 12 63.546 0.0251371 -3.41545 63.546000 Cu 0.220182 0.617716 0.5 28 63.546 0.0081694 -3.41891 63.546000 Cu 0.25113 0.598984 1.19428e-19 242 63.546 0.00498316 -3.41746 63.546000 Cu 0.281803 0.579755 0.5 243 63.546 0.0311228 -3.41732 63.546000 Cu 0.316959 0.594751 3.08124e-17 244 63.546 0.0360766 -3.42105 63.546000 Cu 0.321559 0.628497 0 245 63.546 0.017895 -3.42202 63.546000 Cu 0.286346 0.613466 0.5 247 63.546 0.0117649 -3.42039 63.546000 Cu 0.383025 0.592675 3.08124e-17 191 63.546 0.00847813 -3.42023 63.546000 Cu 0.418466 0.608886 0.5 197 63.546 0.00212684 -3.42091 63.546000 Cu 0.352303 0.610341 0.5 246 63.546 0.0213712 -3.42138 63.546000 Cu 0.387613 0.626292 6.03111e-17 248 63.546 0.00748191 -3.42135 63.546000 Cu 0.515842 0.59087 0 141 63.546 0.000738828 -3.42118 63.546000 Cu 0.44932 0.591672 1.19428e-19 194 63.546 0.000648174 -3.4207 63.546000 Cu 0.453936 0.625092 0 195 63.546 0.000590303 -3.42137 63.546000 Cu 0.484868 0.607942 0.5 196 63.546 0.000312983 -3.42125 63.546000 Cu 0.52045 0.624096 2.43514e-16 198 63.546 0.000708697 -3.42159 63.546000 Cu 0.551457 0.606977 0.5 147 63.546 0.00199981 -3.42175 63.546000 Cu 0.649236 0.588179 1.21936e-16 99 63.546 0.0208673 -3.41909 63.546000 Cu 0.5825 0.589837 0 144 63.546 0.00309246 -3.42139 63.546000 Cu 0.58709 0.622833 0 145 63.546 0.00295469 -3.42208 63.546000 Cu 0.618147 0.605563 0.5 146 63.546 0.00788501 -3.42102 63.546000 Cu 0.653732 0.620933 3.08124e-17 148 63.546 0.011712 -3.42073 63.546000 Cu 0.716001 0.584844 1.19428e-19 102 63.546 0.025152 -3.41603 63.546000 Cu 0.720294 0.61777 1.55973e-16 103 63.546 0.00879494 -3.41922 63.546000 Cu 0.751259 0.599084 0.5 104 63.546 0.00468157 -3.41783 63.546000 Cu 0.684849 0.603135 0.5 105 63.546 0.0204556 -3.41901 63.546000 Cu 0.781965 0.579925 1.19428e-19 65 63.546 0.028401 -3.41786 63.546000 Cu 0.852346 0.610588 1.19428e-19 69 63.546 0.0182793 -3.42136 63.546000 Cu 0.817099 0.594953 0.5 71 63.546 0.034396 -3.42095 63.546000 Cu 0.786427 0.613638 0 106 63.546 0.0105374 -3.42044 63.546000 Cu 0.821624 0.628702 0.5 108 63.546 0.0165438 -3.42201 63.546000 Cu 0.8831 0.592909 0.5 70 63.546 0.00796942 -3.42029 63.546000 Cu 0.887706 0.626511 0.5 75 63.546 0.00716634 -3.42142 63.546000 Cu 0.984908 0.608137 3.08124e-17 41 63.546 0.000219299 -3.42134 63.546000 Cu 0.949372 0.591897 0.5 43 63.546 0.000506983 -3.42086 63.546000 Cu 0.918505 0.609105 3.08124e-17 72 63.546 0.00223476 -3.42088 63.546000 Cu 0.954018 0.625303 0.5 74 63.546 0.000443219 -3.42129 63.546000 Cu 0.0561099 0.640267 3.08124e-17 45 63.546 0.0017558 -3.42203 63.546000 Cu 0.091669 0.656079 0.5 51 63.546 0.00408709 -3.42235 63.546000 Cu 0.0251446 0.6575 0.5 78 63.546 0.00071882 -3.42187 63.546000 Cu 0.0606302 0.673426 4.10832e-17 80 63.546 0.00172329 -3.42229 63.546000 Cu 0.189149 0.635994 1.21697e-16 27 63.546 0.0099999 -3.42021 63.546000 Cu 0.122651 0.638619 4.34718e-17 48 63.546 0.00716256 -3.42183 63.546000 Cu 0.127129 0.671653 1 49 63.546 0.00647197 -3.42232 63.546000 Cu 0.158147 0.653934 0.5 50 63.546 0.00854785 -3.42139 63.546000 Cu 0.193575 0.668953 1 52 63.546 0.0052094 -3.42091 63.546000 Cu 0.224545 0.650726 0.5 30 63.546 0.00286771 -3.42023 63.546000 Cu 0.228919 0.683792 0.5 54 63.546 0.00113147 -3.42096 63.546000 Cu 0.255507 0.632232 0 295 63.546 0.00159615 -3.41988 63.546000 Cu 0.259892 0.665432 0 296 63.546 0.000696168 -3.42084 63.546000 Cu 0.290751 0.64695 0.5 297 63.546 0.0057573 -3.42133 63.546000 Cu 0.295161 0.680297 0.5 301 63.546 0.00370951 -3.4217 63.546000 Cu 0.32602 0.662038 6.15054e-17 298 63.546 0.0101331 -3.42242 63.546000 Cu 0.392187 0.659795 1.19428e-19 249 63.546 0.00608412 -3.42217 63.546000 Cu 0.42306 0.642368 0.5 250 63.546 0.00181543 -3.42161 63.546000 Cu 0.356814 0.643986 0.5 251 63.546 0.013806 -3.42225 63.546000 Cu 0.427646 0.675761 0.5 255 63.546 0.00163491 -3.42205 63.546000 Cu 0.36134 0.67748 0.5 300 63.546 0.00905286 -3.42266 63.546000 Cu 0.525052 0.657303 2.04222e-16 199 63.546 0.000523435 -3.42172 63.546000 Cu 0.489487 0.64124 0.5 201 63.546 0.000172328 -3.42152 63.546000 Cu 0.458563 0.65845 7.69116e-17 252 63.546 0.000397181 -3.42172 63.546000 Cu 0.494089 0.674515 0.5 254 63.546 6.94611e-05 -3.42184 63.546000 Cu 0.622643 0.638495 0.5 151 63.546 0.00634867 -3.42187 63.546000 Cu 0.55604 0.640107 0.5 200 63.546 0.00201192 -3.42204 63.546000 Cu 0.591583 0.655905 1.10113e-16 202 63.546 0.00300948 -3.42229 63.546000 Cu 0.627066 0.671529 0.5 204 63.546 0.00523859 -3.42233 63.546000 Cu 0.560598 0.673262 0.5 205 63.546 0.00181753 -3.42214 63.546000 Cu 0.658122 0.653856 3.65211e-16 149 63.546 0.00772625 -3.42166 63.546000 Cu 0.75561 0.632348 0.5 109 63.546 0.0018573 -3.4201 63.546000 Cu 0.6892 0.635979 0.5 150 63.546 0.00965999 -3.42054 63.546000 Cu 0.724587 0.650777 2.43275e-16 152 63.546 0.00279548 -3.4206 63.546000 Cu 0.728848 0.683885 0 153 63.546 0.00119769 -3.42119 63.546000 Cu 0.759881 0.665573 0.5 154 63.546 0.000423232 -3.42109 63.546000 Cu 0.693535 0.668963 0.5 155 63.546 0.00535767 -3.42139 63.546000 Cu 0.790828 0.647132 1.42119e-17 107 63.546 0.00461489 -3.42144 63.546000 Cu 0.856896 0.644207 4.53826e-18 110 63.546 0.0124692 -3.42239 63.546000 Cu 0.861357 0.677687 4.84878e-17 111 63.546 0.00827335 -3.42279 63.546000 Cu 0.826071 0.662239 0.5 113 63.546 0.00943395 -3.42254 63.546000 Cu 0.795138 0.680474 3.65211e-16 156 63.546 0.00325803 -3.42191 63.546000 Cu 0.989589 0.641437 1.22055e-16 76 63.546 0.000184108 -3.42165 63.546000 Cu 0.994153 0.674713 1.28266e-16 77 63.546 0.000130013 -3.42183 63.546000 Cu 0.923155 0.642563 1.19428e-19 73 63.546 0.00218424 -3.42166 63.546000 Cu 0.958663 0.658662 0.5 79 63.546 0.000369425 -3.42173 63.546000 Cu 0.89228 0.660011 0.5 112 63.546 0.00560535 -3.42226 63.546000 Cu 0.927704 0.675936 0 114 63.546 0.00226774 -3.42204 63.546000 Cu 0.0650229 0.706642 3.08124e-17 81 63.546 0.00197472 -3.4225 63.546000 Cu 0.0960811 0.689215 0.5 82 63.546 0.00429122 -3.42268 63.546000 Cu 0.0295878 0.690723 0.5 83 63.546 0.000592647 -3.42218 63.546000 Cu 0.0339281 0.723964 0.5 120 63.546 0.000585347 -3.42229 63.546000 Cu 0.100394 0.722431 0.5 87 63.546 0.00498599 -3.42271 63.546000 Cu 0.197851 0.701992 3.08124e-17 53 63.546 0.00240343 -3.4215 63.546000 Cu 0.162508 0.686949 0.5 55 63.546 0.00593997 -3.42188 63.546000 Cu 0.131461 0.704786 4.72935e-17 84 63.546 0.00670806 -3.42255 63.546000 Cu 0.166764 0.720078 0.5 86 63.546 0.00486157 -3.42225 63.546000 Cu 0.20201 0.73516 3.08124e-17 88 63.546 0.00198528 -3.42167 63.546000 Cu 0.23312 0.716916 0.5 56 63.546 0.000301258 -3.42123 63.546000 Cu 0.264201 0.69863 3.08124e-17 341 63.546 0.000365614 -3.42128 63.546000 Cu 0.268349 0.7318 3.08124e-17 342 63.546 0.00045074 -3.4212 63.546000 Cu 0.29943 0.713559 0.5 343 63.546 0.00314771 -3.42179 63.546000 Cu 0.330439 0.695416 1.05097e-17 299 63.546 0.00776868 -3.42254 63.546000 Cu 0.396708 0.6932 0 302 63.546 0.00463452 -3.42247 63.546000 Cu 0.401059 0.726509 2.18434e-16 303 63.546 0.00383677 -3.42252 63.546000 Cu 0.432101 0.709085 0.5 304 63.546 0.00157393 -3.42223 63.546000 Cu 0.365741 0.710841 0.5 305 63.546 0.00689524 -3.42281 63.546000 Cu 0.334678 0.728692 2.94987e-17 344 63.546 0.00655751 -3.42246 63.546000 Cu 0.463135 0.691767 1.02469e-16 253 63.546 0.000405173 -3.42204 63.546000 Cu 0.529598 0.690539 1.28982e-16 256 63.546 0.000524003 -3.42202 63.546000 Cu 0.533981 0.723807 2.43394e-16 257 63.546 0.000564711 -3.42213 63.546000 Cu 0.498572 0.707794 0.5 259 63.546 4.31313e-05 -3.42208 63.546000 Cu 0.467498 0.725049 1.49404e-16 306 63.546 0.000333153 -3.42204 63.546000 Cu 0.596065 0.689066 1.43552e-16 203 63.546 0.0035891 -3.42246 63.546000 Cu 0.631442 0.704683 0.5 209 63.546 0.00511094 -3.42263 63.546000 Cu 0.565028 0.706473 0.5 258 63.546 0.00155435 -3.42237 63.546000 Cu 0.600417 0.722304 3.08124e-17 260 63.546 0.00397231 -3.42265 63.546000 Cu 0.662473 0.686901 1.43433e-16 206 63.546 0.00532826 -3.42213 63.546000 Cu 0.764101 0.698774 0.5 159 63.546 0.000223626 -3.42138 63.546000 Cu 0.66676 0.720081 3.08124e-17 207 63.546 0.0050262 -3.42242 63.546000 Cu 0.69779 0.702061 0.5 208 63.546 0.00338852 -3.42177 63.546000 Cu 0.733059 0.717039 3.08124e-17 210 63.546 0.000484879 -3.42126 63.546000 Cu 0.702018 0.73525 0.5 213 63.546 0.00286587 -3.42178 63.546000 Cu 0.768292 0.731948 0.5 212 63.546 0.000461742 -3.42128 63.546000 Cu 0.799337 0.713744 3.08124e-17 157 63.546 0.00257908 -3.42179 63.546000 Cu 0.830372 0.695632 0.5 158 63.546 0.00598934 -3.42262 63.546000 Cu 0.865633 0.711033 3.08124e-17 160 63.546 0.00662549 -3.4227 63.546000 Cu 0.834592 0.72889 0.5 163 63.546 0.00536187 -3.42233 63.546000 Cu 0.998521 0.707984 1.19428e-19 118 63.546 9.42126e-05 -3.4221 63.546000 Cu 0.932026 0.709265 0 115 63.546 0.00165492 -3.42232 63.546000 Cu 0.963111 0.691956 0.5 116 63.546 0.00034934 -3.42212 63.546000 Cu 0.896678 0.693388 0.5 117 63.546 0.00487765 -3.42265 63.546000 Cu 0.967395 0.725211 0.5 121 63.546 0.000401724 -3.42212 63.546000 Cu 0.900942 0.726672 0.5 162 63.546 0.00446146 -3.42256 63.546000 Cu 0.00280103 0.741219 6.95071e-17 119 63.546 3.08575e-05 -3.42208 63.546000 Cu 0.0693 0.739898 3.68555e-16 122 63.546 0.00234735 -3.42244 63.546000 Cu 0.0735836 0.773205 1.22414e-16 123 63.546 0.00255991 -3.42224 63.546000 Cu 0.0382353 0.757225 0.5 125 63.546 0.000573643 -3.4221 63.546000 Cu 0.00712728 0.774474 3.08124e-17 168 63.546 5.13721e-05 -3.42203 63.546000 Cu 0.104647 0.755719 0.5 124 63.546 0.00574167 -3.42261 63.546000 Cu 0.108852 0.789107 0.5 129 63.546 0.00731447 -3.42242 63.546000 Cu 0.135698 0.73801 9.90058e-17 85 63.546 0.00700307 -3.42276 63.546000 Cu 0.206124 0.768395 1.50718e-16 89 63.546 0.00207879 -3.42146 63.546000 Cu 0.17094 0.753338 0.5 90 63.546 0.00594902 -3.42226 63.546000 Cu 0.139886 0.77135 3.08124e-17 126 63.546 0.00909374 -3.42264 63.546000 Cu 0.175071 0.786696 0.5 128 63.546 0.00796593 -3.42221 63.546000 Cu 0.303595 0.746738 0.5 347 63.546 0.00351573 -3.42153 63.546000 Cu 0.237227 0.750073 0.5 379 63.546 0.000116203 -3.42109 63.546000 Cu 0.272438 0.76493 1.24205e-17 380 63.546 0.00116559 -3.4209 63.546000 Cu 0.307653 0.779832 0.5 382 63.546 0.00516478 -3.42115 63.546000 Cu 0.241292 0.783263 0.5 383 63.546 0.000400203 -3.42072 63.546000 Cu 0.338843 0.761846 2.30854e-16 345 63.546 0.00718104 -3.42208 63.546000 Cu 0.369982 0.744093 0.5 346 63.546 0.00583409 -3.4226 63.546000 Cu 0.405322 0.759724 2.60353e-17 348 63.546 0.00368675 -3.42258 63.546000 Cu 0.374139 0.777231 0.5 351 63.546 0.00652254 -3.42241 63.546000 Cu 0.436443 0.742339 0.5 309 63.546 0.00169423 -3.42227 63.546000 Cu 0.440658 0.775566 0.5 350 63.546 0.00135719 -3.42239 63.546000 Cu 0.471819 0.758301 3.08124e-17 307 63.546 0.000339435 -3.42226 63.546000 Cu 0.502926 0.741055 0.5 308 63.546 3.53917e-05 -3.42202 63.546000 Cu 0.538325 0.757085 7.21345e-17 310 63.546 0.000551667 -3.4221 63.546000 Cu 0.507188 0.774328 0.5 313 63.546 3.96528e-05 -3.42211 63.546000 Cu 0.635743 0.737942 0.5 262 63.546 0.00573357 -3.42281 63.546000 Cu 0.604722 0.755626 0 261 63.546 0.00490456 -3.42258 63.546000 Cu 0.569386 0.739751 0.5 263 63.546 0.00179384 -3.42231 63.546000 Cu 0.639951 0.771332 0.5 267 63.546 0.00858856 -3.42274 63.546000 Cu 0.573644 0.773078 0.5 312 63.546 0.00180301 -3.42209 63.546000 Cu 0.60893 0.789019 3.29621e-17 314 63.546 0.00566282 -3.42217 63.546000 Cu 0.737247 0.75022 3.08124e-17 211 63.546 0.000259378 -3.4213 63.546000 Cu 0.670993 0.753368 3.08124e-17 264 63.546 0.00604218 -3.42258 63.546000 Cu 0.675142 0.786777 1.30177e-17 265 63.546 0.00939336 -3.42234 63.546000 Cu 0.706159 0.768522 0.5 266 63.546 0.00300882 -3.42164 63.546000 Cu 0.741311 0.783428 1 268 63.546 0.000535126 -3.42085 63.546000 Cu 0.772463 0.765112 0.5 217 63.546 0.000998323 -3.4211 63.546000 Cu 0.869906 0.744281 2.43633e-16 161 63.546 0.00552727 -3.4226 63.546000 Cu 0.803558 0.74692 3.08124e-17 214 63.546 0.0033009 -3.42171 63.546000 Cu 0.807673 0.780027 3.08124e-17 215 63.546 0.00481871 -3.42116 63.546000 Cu 0.838834 0.762054 0.5 216 63.546 0.00617709 -3.4221 63.546000 Cu 0.874134 0.777422 3.08124e-17 218 63.546 0.00625235 -3.42237 63.546000 Cu 0.936317 0.742509 1.21936e-16 164 63.546 0.0016708 -3.42234 63.546000 Cu 0.940615 0.775728 2.8185e-17 165 63.546 0.0014187 -3.42236 63.546000 Cu 0.971745 0.75846 0.5 166 63.546 0.000353376 -3.42214 63.546000 Cu 0.905265 0.759902 0.5 167 63.546 0.00380718 -3.42252 63.546000 Cu 0.0113896 0.807737 3.08124e-17 169 63.546 0.000196713 -3.42185 63.546000 Cu 0.0424922 0.790525 0.5 170 63.546 0.00061446 -3.42204 63.546000 Cu 0.0778158 0.806599 1.05097e-16 172 63.546 0.00313361 -3.422 63.546000 Cu 0.0821107 0.840065 1.19428e-19 173 63.546 0.0036287 -3.42131 63.546000 Cu 0.0467754 0.823889 0.5 175 63.546 0.000834237 -3.42169 63.546000 Cu 0.0156998 0.841036 3.08124e-17 226 63.546 0.000241874 -3.4216 63.546000 Cu 0.14406 0.804814 4.80101e-17 127 63.546 0.0126385 -3.42242 63.546000 Cu 0.179201 0.820217 0.5 132 63.546 0.0138162 -3.42173 63.546000 Cu 0.113086 0.822601 0.5 174 63.546 0.00894543 -3.42182 63.546000 Cu 0.148305 0.838417 1.19428e-19 176 63.546 0.0178612 -3.42149 63.546000 Cu 0.210181 0.801735 7.17762e-17 130 63.546 0.00345031 -3.42106 63.546000 Cu 0.21423 0.835229 3.08124e-17 131 63.546 0.00876457 -3.4199 63.546000 Cu 0.276451 0.798035 9.68561e-17 381 63.546 0.00295935 -3.42019 63.546000 Cu 0.311684 0.812832 0.5 387 63.546 0.00962321 -3.42028 63.546000 Cu 0.245261 0.816497 0.5 411 63.546 0.00160363 -3.4197 63.546000 Cu 0.280424 0.831073 2.81133e-16 412 63.546 0.00815043 -3.41878 63.546000 Cu 0.409464 0.792884 2.78387e-16 349 63.546 0.00346934 -3.42233 63.546000 Cu 0.342935 0.794916 2.43394e-16 384 63.546 0.00880896 -3.42165 63.546000 Cu 0.347006 0.827854 1.40447e-16 385 63.546 0.0130218 -3.42068 63.546000 Cu 0.378258 0.810289 0.5 386 63.546 0.00735038 -3.42182 63.546000 Cu 0.413628 0.825958 2.43753e-16 388 63.546 0.0036634 -3.42198 63.546000 Cu 0.542543 0.790387 1.19547e-16 311 63.546 0.000433724 -3.422 63.546000 Cu 0.476021 0.791538 1.21936e-16 352 63.546 0.000347478 -3.42212 63.546000 Cu 0.48026 0.824754 1.19428e-19 353 63.546 0.000428768 -3.42194 63.546000 Cu 0.511417 0.807604 0.5 354 63.546 0.00013287 -3.42188 63.546000 Cu 0.444851 0.80874 0.5 355 63.546 0.00135248 -3.42221 63.546000 Cu 0.515661 0.840888 0.5 359 63.546 0.000265251 -3.42157 63.546000 Cu 0.546773 0.823738 2.0458e-16 356 63.546 0.000565484 -3.42175 63.546000 Cu 0.449064 0.841871 0.5 390 63.546 0.00132294 -3.42174 63.546000 Cu 0.613155 0.822504 3.08124e-17 315 63.546 0.0064553 -3.42178 63.546000 Cu 0.644154 0.804812 0.5 316 63.546 0.0122091 -3.42235 63.546000 Cu 0.577881 0.806458 0.5 317 63.546 0.00193398 -3.42194 63.546000 Cu 0.648328 0.838454 0.5 321 63.546 0.0190688 -3.42153 63.546000 Cu 0.582126 0.839922 0.5 358 63.546 0.00222476 -3.42133 63.546000 Cu 0.745337 0.816669 1 269 63.546 0.00157581 -3.41963 63.546000 Cu 0.71024 0.801892 0.5 271 63.546 0.00498782 -3.42117 63.546000 Cu 0.679288 0.820337 3.08124e-17 318 63.546 0.0177026 -3.42189 63.546000 Cu 0.714313 0.835391 0.5 320 63.546 0.0103429 -3.41986 63.546000 Cu 0.776508 0.798216 0.5 270 63.546 0.00292631 -3.42031 63.546000 Cu 0.842944 0.795116 0.5 221 63.546 0.00789875 -3.42153 63.546000 Cu 0.811741 0.813019 3.08124e-17 272 63.546 0.00928943 -3.42014 63.546000 Cu 0.847076 0.828037 0.5 274 63.546 0.0127951 -3.42071 63.546000 Cu 0.78046 0.831252 0.5 275 63.546 0.00821046 -3.41868 63.546000 Cu 0.878292 0.810466 3.08124e-17 219 63.546 0.00729609 -3.42189 63.546000 Cu 0.975991 0.791683 0.5 171 63.546 0.000394732 -3.42202 63.546000 Cu 0.909462 0.793053 0.5 220 63.546 0.0035313 -3.42232 63.546000 Cu 0.944846 0.808891 3.08124e-17 222 63.546 0.00138469 -3.42212 63.546000 Cu 0.980283 0.824886 0.5 224 63.546 0.000689528 -3.42188 63.546000 Cu 0.913678 0.826131 0.5 225 63.546 0.00326004 -3.42212 63.546000 Cu 0.949126 0.842015 1 223 63.546 0.00163094 -3.42187 63.546000 Cu 0.020079 0.874359 3.08124e-17 227 63.546 0.00038768 -3.42098 63.546000 Cu 0.0510988 0.857282 0.5 228 63.546 0.000862903 -3.42114 63.546000 Cu 0.0864897 0.873567 1.19428e-19 230 63.546 0.00290946 -3.42049 63.546000 Cu 0.0555532 0.89073 0.5 233 63.546 0.000995557 -3.42049 63.546000 Cu 0.152628 0.872189 3.08124e-17 177 63.546 0.0256415 -3.41961 63.546000 Cu 0.18341 0.853953 0.5 178 63.546 0.0298288 -3.42071 63.546000 Cu 0.117399 0.856171 0.5 179 63.546 0.00920371 -3.4207 63.546000 Cu 0.18777 0.887985 0.5 182 63.546 0.068481 -3.41806 63.546000 Cu 0.12182 0.88985 0.5 232 63.546 0.00755599 -3.41903 63.546000 Cu 0.218392 0.868956 1.22055e-16 180 63.546 0.0263738 -3.41723 63.546000 Cu 0.284412 0.864022 4.57409e-17 413 63.546 0.0235751 -3.41557 63.546000 Cu 0.3157 0.845687 0.5 414 63.546 0.0208782 -3.41873 63.546000 Cu 0.249265 0.849776 0.5 415 63.546 0.00471874 -3.41741 63.546000 Cu 0.319796 0.878334 0.5 419 63.546 0.0529029 -3.4163 63.546000 Cu 0.25326 0.883167 0.5 433 63.546 0.0147678 -3.41093 63.546000 Cu 0.417904 0.85897 2.38856e-19 389 63.546 0.00354754 -3.42165 63.546000 Cu 0.38241 0.843232 0.5 391 63.546 0.00902451 -3.42131 63.546000 Cu 0.351149 0.860641 3.08124e-17 416 63.546 0.021752 -3.41943 63.546000 Cu 0.386639 0.876105 0.5 418 63.546 0.00884019 -3.42068 63.546000 Cu 0.422205 0.891936 3.08124e-17 420 63.546 0.00311906 -3.42113 63.546000 Cu 0.355356 0.893273 3.08124e-17 417 63.546 0.0342354 -3.41699 63.546000 Cu 0.484557 0.857967 0 392 63.546 0.000515042 -3.42138 63.546000 Cu 0.488943 0.891178 6.58048e-17 393 63.546 0.00064065 -3.42095 63.546000 Cu 0.520056 0.874207 0.5 394 63.546 0.000421707 -3.42106 63.546000 Cu 0.453421 0.874966 0.5 395 63.546 0.00147807 -3.42126 63.546000 Cu 0.5511 0.857127 3.08124e-17 357 63.546 0.000541733 -3.42106 63.546000 Cu 0.5555 0.890573 1.19428e-19 396 63.546 0.000693318 -3.42047 63.546000 Cu 0.617419 0.856124 2.38856e-19 360 63.546 0.00801515 -3.42043 63.546000 Cu 0.62179 0.889846 3.33204e-17 361 63.546 0.00771815 -3.41872 63.546000 Cu 0.652644 0.872267 0.5 362 63.546 0.0288416 -3.41938 63.546000 Cu 0.586491 0.87345 0.5 363 63.546 0.00186823 -3.42028 63.546000 Cu 0.683442 0.854094 3.08124e-17 319 63.546 0.0353947 -3.42085 63.546000 Cu 0.749327 0.849944 3.08124e-17 322 63.546 0.00473011 -3.41728 63.546000 Cu 0.753297 0.883304 1.21578e-16 323 63.546 0.0151722 -3.41057 63.546000 Cu 0.71844 0.869115 0.5 325 63.546 0.0287971 -3.41713 63.546000 Cu 0.687754 0.888124 1.84397e-16 364 63.546 0.075011 -3.41798 63.546000 Cu 0.815773 0.845853 1.27071e-16 273 63.546 0.021657 -3.41872 63.546000 Cu 0.851234 0.860813 0.5 279 63.546 0.0211785 -3.41908 63.546000 Cu 0.784466 0.864178 0.5 324 63.546 0.0239011 -3.41524 63.546000 Cu 0.819867 0.878469 4.37106e-17 326 63.546 0.054445 -3.41585 63.546000 Cu 0.882475 0.843424 1.19428e-19 276 63.546 0.00773831 -3.4213 63.546000 Cu 0.886735 0.876269 3.08124e-17 277 63.546 0.00821282 -3.42023 63.546000 Cu 0.855453 0.893406 0.5 328 63.546 0.0339368 -3.41653 63.546000 Cu 0.989034 0.891329 0.5 282 63.546 0.000700601 -3.42095 63.546000 Cu 0.984597 0.858103 0.5 229 63.546 0.000710992 -3.42143 63.546000 Cu 0.917959 0.859139 0.5 278 63.546 0.00329747 -3.42158 63.546000 Cu 0.953494 0.875113 1 280 63.546 0.00175408 -3.42126 63.546000 Cu 0.92233 0.892087 0.5 283 63.546 0.00324435 -3.42096 63.546000 Cu 0.0910055 0.907163 0 231 63.546 0.0020961 -3.41933 63.546000 Cu 0.024586 0.907729 1.18473e-16 284 63.546 0.00049105 -3.42044 63.546000 Cu 0.0290762 0.941129 2.01833e-17 285 63.546 0.00775804 -3.41991 63.546000 Cu 0.0601338 0.924247 0.5 286 63.546 0.00141551 -3.41956 63.546000 Cu 0.0956619 0.940823 2.9021e-17 288 63.546 0.00630894 -3.41824 63.546000 Cu 0.157076 0.906153 6.1386e-17 234 63.546 0.0319526 -3.41599 63.546000 Cu 0.161981 0.940267 3.08124e-17 235 63.546 0.0305323 -3.41224 63.546000 Cu 0.192385 0.922381 0.5 236 63.546 0.146981 -3.41043 63.546000 Cu 0.126444 0.923645 0.5 237 63.546 0.0044698 -3.41682 63.546000 Cu 0.222781 0.903069 3.08124e-17 181 63.546 0.0897854 -3.41348 63.546000 Cu 0.227832 0.93774 3.08124e-17 238 63.546 0.355563 -3.38771 63.546000 Cu 0.288293 0.896775 3.08124e-17 434 63.546 0.0864478 -3.40552 63.546000 Cu 0.292179 0.928973 3.08124e-17 435 63.546 0.431974 -3.36869 63.546000 Cu 0.257307 0.916839 0.5 437 63.546 0.0568702 -3.38977 63.546000 Cu 0.323949 0.910651 0.5 436 63.546 0.149392 -3.41339 63.546000 Cu 0.328637 0.942589 0.5 441 63.546 0.388901 -3.40759 63.546000 Cu 0.426644 0.924865 4.8846e-17 421 63.546 0.00306497 -3.42094 63.546000 Cu 0.390921 0.908887 0.5 423 63.546 0.00719697 -3.42048 63.546000 Cu 0.359619 0.925808 3.08124e-17 438 63.546 0.0355463 -3.41633 63.546000 Cu 0.395554 0.941584 0.5 440 63.546 0.0125722 -3.4193 63.546000 Cu 0.524479 0.907559 0.5 399 63.546 0.000624599 -3.42044 63.546000 Cu 0.457797 0.908063 0.5 422 63.546 0.00133248 -3.42094 63.546000 Cu 0.493411 0.924408 1.22055e-16 424 63.546 0.00146766 -3.42026 63.546000 Cu 0.528902 0.940944 0.5 426 63.546 0.00713482 -3.41981 63.546000 Cu 0.462211 0.941145 0.5 427 63.546 0.00800513 -3.42059 63.546000 Cu 0.560008 0.924098 6.16248e-17 397 63.546 0.00113086 -3.41949 63.546000 Cu 0.590919 0.907074 0.5 398 63.546 0.00154781 -3.41908 63.546000 Cu 0.626351 0.923682 3.08124e-17 400 63.546 0.0052008 -3.41655 63.546000 Cu 0.59553 0.940772 0.5 403 63.546 0.00594969 -3.4179 63.546000 Cu 0.65703 0.906255 0.5 367 63.546 0.0365111 -3.41578 63.546000 Cu 0.661875 0.940384 0.5 402 63.546 0.0347174 -3.4124 63.546000 Cu 0.692344 0.922517 0 365 63.546 0.154591 -3.41079 63.546000 Cu 0.722745 0.903213 0.5 366 63.546 0.0944972 -3.41348 63.546000 Cu 0.757301 0.91695 1.25758e-16 368 63.546 0.0586657 -3.38912 63.546000 Cu 0.727811 0.937868 0.5 371 63.546 0.361459 -3.38928 63.546000 Cu 0.824014 0.910742 7.78671e-17 327 63.546 0.153742 -3.41274 63.546000 Cu 0.78834 0.896878 0.5 329 63.546 0.0902499 -3.40475 63.546000 Cu 0.859736 0.925907 0.5 333 63.546 0.0364625 -3.41563 63.546000 Cu 0.792209 0.929033 0.5 370 63.546 0.449927 -3.36673 63.546000 Cu 0.828731 0.942639 1.18234e-16 372 63.546 0.400856 -3.40617 63.546000 Cu 0.993574 0.924596 0.5 287 63.546 0.00141815 -3.42043 63.546000 Cu 0.957936 0.908228 2.14015e-16 281 63.546 0.00133809 -3.42112 63.546000 Cu 0.89107 0.909022 0 330 63.546 0.00726081 -3.42019 63.546000 Cu 0.895713 0.941696 3.08124e-17 331 63.546 0.0129604 -3.41881 63.546000 Cu 0.926808 0.925028 0.5 332 63.546 0.00300271 -3.42084 63.546000 Cu 0.962418 0.94134 0 334 63.546 0.00866016 -3.42049 63.546000 Cu 0.0642612 0.957744 0.5 291 63.546 0.030887 -3.42086 63.546000 Cu 0.0315659 0.97448 1.21936e-16 338 63.546 0.0449684 -3.42298 63.546000 Cu 0.0644028 0.991177 0.5 339 63.546 0.0333644 -3.42079 63.546000 Cu 0.0987556 0.974405 6.53271e-17 289 63.546 0.072815 -3.42282 63.546000 Cu 0.198029 0.957136 0.5 240 63.546 0.329002 -3.38906 63.546000 Cu 0.131326 0.957509 0.5 290 63.546 0.047749 -3.41542 63.546000 Cu 0.166478 0.974348 3.58284e-19 292 63.546 0.194342 -3.40296 63.546000 Cu 0.198166 0.991644 0.5 293 63.546 0.327207 -3.39044 63.546000 Cu 0.131458 0.991213 0.5 294 63.546 0.0509838 -3.4154 63.546000 Cu 0.262182 0.997797 0.5 511 63.546 5.64038 -3.23646 63.546000 Cu 0.235701 0.974441 3.08124e-17 239 63.546 4.42081 -3.38614 63.546000 Cu 0.26199 0.95105 0.5 447 63.546 5.646 -3.23814 63.546000 Cu 0.29805 0.959649 1.19428e-19 448 63.546 5.43187 -3.12963 63.546000 Cu 0.298237 0.989299 1.19428e-19 449 63.546 5.44292 -3.12709 63.546000 Cu 0.331605 0.974466 0.5 450 63.546 3.34786 -3.33781 63.546000 Cu 0.364335 0.958215 1.19428e-19 439 63.546 0.0587451 -3.41516 63.546000 Cu 0.43065 0.957828 1.19428e-19 442 63.546 0.0282196 -3.42101 63.546000 Cu 0.398258 0.974393 0.5 445 63.546 0.0510211 -3.42307 63.546000 Cu 0.364538 0.990675 3.08124e-17 452 63.546 0.066489 -3.41521 63.546000 Cu 0.430863 0.990864 4.95626e-17 443 63.546 0.0313585 -3.42087 63.546000 Cu 0.497238 0.957651 2.04222e-17 425 63.546 0.0248083 -3.42148 63.546000 Cu 0.531413 0.974277 0.5 431 63.546 0.0440418 -3.42289 63.546000 Cu 0.464671 0.974293 0.5 444 63.546 0.041074 -3.42257 63.546000 Cu 0.497436 0.990889 2.38856e-19 446 63.546 0.0278001 -3.42174 63.546000 Cu 0.631177 0.957553 8.21665e-17 401 63.546 0.0456238 -3.4151 63.546000 Cu 0.564102 0.957612 1.19428e-19 428 63.546 0.0295823 -3.42058 63.546000 Cu 0.56429 0.991037 1.21936e-16 429 63.546 0.033336 -3.42124 63.546000 Cu 0.598621 0.974367 0.5 430 63.546 0.071912 -3.42289 63.546000 Cu 0.631357 0.991236 2.92599e-17 432 63.546 0.0501569 -3.4158 63.546000 Cu 0.666383 0.974416 0.5 407 63.546 0.193666 -3.40312 63.546000 Cu 0.762196 0.997725 1.19428e-19 454 63.546 5.58969 -3.23824 63.546000 Cu 0.76201 0.951165 7.60756e-17 369 63.546 5.6048 -3.23912 63.546000 Cu 0.69795 0.957232 0 404 63.546 0.328966 -3.39031 63.546000 Cu 0.698112 0.991664 1.19428e-19 405 63.546 0.321662 -3.391 63.546000 Cu 0.735677 0.974456 0.5 406 63.546 4.39271 -3.39009 63.546000 Cu 0.831734 0.974462 1.19428e-19 373 63.546 3.35716 -3.3371 63.546000 Cu 0.864484 0.958264 0.5 374 63.546 0.0617561 -3.41453 63.546000 Cu 0.798138 0.959661 0.5 375 63.546 5.42496 -3.12647 63.546000 Cu 0.864625 0.990688 0.5 378 63.546 0.0666124 -3.41483 63.546000 Cu 0.798276 0.98925 0.5 409 63.546 5.42752 -3.12495 63.546000 Cu 0.997434 0.957857 0.5 336 63.546 0.0264007 -3.42155 63.546000 Cu 0.997554 0.991114 0.5 340 63.546 0.0283016 -3.4218 63.546000 Cu 0.964843 0.97447 5.0518e-17 335 63.546 0.0426297 -3.42248 63.546000 Cu 0.930861 0.957974 0.5 337 63.546 0.0307249 -3.42067 63.546000 Cu 0.89842 0.974474 4.70546e-17 376 63.546 0.053848 -3.42283 63.546000 Cu 0.930974 0.990983 0.5 377 63.546 0.032054 -3.42099