228 jmolscript: load "" {1 1 1} spacegroup "x,y,z" unitcell [{ 12.816400 0.000000 0.000000 }, { 0.000000 22.286600 0.000000 }, { 0.000000 -11.143300 19.300762 }] Cu 3.204100 -4.224425 7.316919 0.851354 Cu 3.204100 -2.994205 5.186115 0.812019 Cu 3.204100 8.448850 0.000000 0.851320 Cu 3.204100 5.988409 0.000000 0.812039 Cu 3.204100 6.918875 11.983843 0.851622 Cu 3.204100 8.149095 14.114647 0.811877 Cu 9.612300 -6.918875 11.983843 0.851455 Cu 9.612300 -8.149095 14.114647 0.811955 Cu 9.612300 13.837750 0.000000 0.851471 Cu 9.612300 16.298191 0.000000 0.811966 Cu 9.612300 4.224425 7.316919 0.851307 Cu 9.612300 2.994205 5.186115 0.812054 H 1.230374 14.694670 6.429084 0.120059 H 1.230374 9.363715 3.360263 0.120056 H 1.230374 9.371515 9.511416 0.120056 H 7.638574 -3.551370 12.871678 0.120054 H 7.638574 1.779585 15.940499 0.120062 H 7.638574 1.771785 9.789346 0.120055 H 5.177826 3.551370 12.871678 0.120058 H 5.177826 -1.779585 15.940499 0.120054 H 5.177826 -1.771785 9.789346 0.120059 H 11.586026 7.591930 6.429084 0.120055 H 11.586026 12.922885 3.360263 0.120058 H 11.586026 12.915085 9.511416 0.120059 H 11.586026 -3.551370 12.871678 0.120054 H 11.586026 1.779585 15.940499 0.120062 H 11.586026 1.771785 9.789346 0.120055 H 5.177826 14.694670 6.429084 0.120059 H 5.177826 9.363715 3.360263 0.120056 H 5.177826 9.371515 9.511416 0.120056 H 7.638574 7.591930 6.429084 0.120055 H 7.638574 12.922885 3.360263 0.120058 H 7.638574 12.915085 9.511416 0.120058 H 1.230374 3.551370 12.871678 0.120058 H 1.230374 -1.779585 15.940499 0.120054 H 1.230374 -1.771785 9.789346 0.120059 H 0.000000 17.033091 3.033115 0.132725 H 0.000000 5.253509 3.033115 0.132726 H 0.000000 11.143300 13.234533 0.132730 H 6.408200 -5.889791 16.267647 0.132724 H 6.408200 5.889791 16.267647 0.132733 H 6.408200 0.000000 6.066229 0.132725 H 0.000000 -5.889791 16.267647 0.132724 H 0.000000 5.889791 16.267647 0.132733 H 0.000000 0.000000 6.066229 0.132724 H 6.408200 17.033091 3.033115 0.132725 H 6.408200 5.253509 3.033115 0.132726 H 6.408200 11.143300 13.234533 0.132730 H 0.000000 11.143300 3.948936 0.107470 H 0.000000 8.991529 7.675913 0.107468 H 0.000000 13.295071 7.675913 0.107470 H 6.408200 0.000000 15.351826 0.107469 H 6.408200 2.151771 11.624849 0.107468 H 6.408200 -2.151771 11.624849 0.107472 H 0.000000 0.000000 15.351826 0.107469 H 0.000000 2.151771 11.624849 0.107468 H 0.000000 -2.151771 11.624849 0.107472 H 6.408200 11.143300 3.948936 0.107470 H 6.408200 8.991529 7.675913 0.107468 H 6.408200 13.295071 7.675913 0.107470 C 0.671579 14.754844 5.494927 -0.123211 C 1.505927 17.074879 5.332801 0.575267 C 0.681832 15.965006 4.788519 -0.019720 C 0.671579 8.524624 3.775229 -0.123217 C 1.505927 7.224201 1.847083 0.575266 C 0.681832 7.307776 3.080402 -0.019724 C 0.671579 10.150432 10.030606 -0.123195 C 1.505927 9.130820 12.120879 0.575280 C 0.681832 10.157118 11.431841 -0.019723 C 7.079779 -3.611544 13.805835 -0.123217 C 7.914127 -5.931579 13.967961 0.575265 C 7.090032 -4.821706 14.512243 -0.019722 C 7.079779 2.618676 15.525533 -0.123189 C 7.914127 3.919099 17.453679 0.575274 C 7.090032 3.835524 16.220360 -0.019717 C 7.079779 0.992868 9.270156 -0.123215 C 7.914127 2.012480 7.179883 0.575265 C 7.090032 0.986182 7.868921 -0.019722 C 5.736621 3.611544 13.805835 -0.123191 C 4.902273 5.931579 13.967961 0.575280 C 5.726368 4.821706 14.512243 -0.019719 C 5.736621 -2.618675 15.525533 -0.123216 C 4.902273 -3.919099 17.453679 0.575266 C 5.726368 -3.835524 16.220360 -0.019724 C 5.736621 -0.992868 9.270156 -0.123217 C 4.902273 -2.012480 7.179883 0.575268 C 5.726368 -0.986182 7.868921 -0.019724 C 12.144821 7.531756 5.494927 -0.123215 C 11.310473 5.211721 5.332801 0.575266 C 12.134568 6.321594 4.788519 -0.019723 C 12.144821 13.761975 3.775229 -0.123217 C 11.310473 15.062399 1.847083 0.575269 C 12.134568 14.978824 3.080402 -0.019724 C 12.144821 12.136168 10.030606 -0.123189 C 11.310473 13.155780 12.120879 0.575271 C 12.134568 12.129482 11.431841 -0.019714 C 12.144821 -3.611544 13.805835 -0.123217 C 11.310473 -5.931579 13.967961 0.575266 C 12.134568 -4.821706 14.512243 -0.019722 C 12.144821 2.618676 15.525533 -0.123189 C 11.310473 3.919099 17.453679 0.575274 C 12.134568 3.835524 16.220360 -0.019717 C 12.144821 0.992868 9.270156 -0.123215 C 11.310473 2.012480 7.179883 0.575266 C 12.134568 0.986182 7.868921 -0.019722 C 5.736621 14.754844 5.494927 -0.123212 C 4.902273 17.074879 5.332801 0.575267 C 5.726368 15.965006 4.788519 -0.019720 C 5.736621 8.524624 3.775229 -0.123217 C 4.902273 7.224201 1.847083 0.575266 C 5.726368 7.307776 3.080402 -0.019724 C 5.736621 10.150432 10.030606 -0.123195 C 4.902273 9.130820 12.120879 0.575280 C 5.726368 10.157118 11.431841 -0.019724 C 7.079779 7.531756 5.494927 -0.123215 C 7.914127 5.211721 5.332801 0.575266 C 7.090032 6.321594 4.788519 -0.019723 C 7.079779 13.761975 3.775229 -0.123217 C 7.914127 15.062399 1.847083 0.575269 C 7.090032 14.978824 3.080402 -0.019724 C 7.079779 12.136168 10.030606 -0.123189 C 7.914127 13.155780 12.120879 0.575271 C 7.090032 12.129482 11.431841 -0.019714 C 0.671579 3.611544 13.805835 -0.123191 C 1.505927 5.931579 13.967961 0.575279 C 0.681832 4.821706 14.512243 -0.019719 C 0.671579 -2.618675 15.525533 -0.123216 C 1.505927 -3.919099 17.453679 0.575266 C 0.681832 -3.835524 16.220360 -0.019724 C 0.671579 -0.992868 9.270156 -0.123217 C 1.505927 -2.012480 7.179883 0.575268 C 0.681832 -0.986182 7.868921 -0.019724 C 0.000000 12.361263 5.730396 0.081405 C 0.000000 13.636613 4.994072 0.064107 C 0.000000 16.090368 3.577396 -0.094616 C 0.000000 9.925337 5.730396 0.081409 C 0.000000 8.649987 4.994072 0.064101 C 0.000000 6.196232 3.577396 -0.094624 C 0.000000 11.143300 7.839970 0.081404 C 0.000000 11.143300 9.312618 0.064099 C 0.000000 11.143300 12.145970 -0.094652 C 6.408200 -1.217963 13.570366 0.081410 C 6.408200 -2.493313 14.306690 0.064101 C 6.408200 -4.947068 15.723366 -0.094619 C 6.408200 1.217963 13.570366 0.081400 C 6.408200 2.493313 14.306690 0.064104 C 6.408200 4.947068 15.723366 -0.094651 C 6.408200 0.000000 11.460792 0.081409 C 6.408200 0.000000 9.988144 0.064102 C 6.408200 0.000000 7.154792 -0.094623 C 0.000000 -1.217963 13.570366 0.081409 C 0.000000 -2.493313 14.306690 0.064101 C 0.000000 -4.947068 15.723366 -0.094619 C 0.000000 1.217963 13.570366 0.081400 C 0.000000 2.493313 14.306690 0.064103 C 0.000000 4.947068 15.723366 -0.094651 C 0.000000 0.000000 11.460792 0.081409 C 0.000000 0.000000 9.988144 0.064102 C 0.000000 0.000000 7.154792 -0.094624 C 6.408200 12.361263 5.730396 0.081405 C 6.408200 13.636613 4.994072 0.064107 C 6.408200 16.090368 3.577396 -0.094617 C 6.408200 9.925337 5.730396 0.081409 C 6.408200 8.649987 4.994072 0.064101 C 6.408200 6.196232 3.577396 -0.094625 C 6.408200 11.143300 7.839970 0.081404 C 6.408200 11.143300 9.312618 0.064099 C 6.408200 11.143300 12.145970 -0.094653 C 0.000000 11.143300 5.041359 -0.178979 C 0.000000 9.937595 7.129701 -0.178982 C 0.000000 12.349005 7.129701 -0.178982 C 6.408200 0.000000 14.259403 -0.178982 C 6.408200 1.205705 12.171061 -0.178984 C 6.408200 -1.205705 12.171061 -0.178977 C 0.000000 0.000000 14.259403 -0.178982 C 0.000000 1.205705 12.171061 -0.178985 C 0.000000 -1.205705 12.171061 -0.178977 C 6.408200 11.143300 5.041359 -0.178980 C 6.408200 9.937595 7.129701 -0.178983 C 6.408200 12.349005 7.129701 -0.178982 O 1.823774 18.025402 4.547260 -0.501968 O 1.858378 16.923330 6.556469 -0.522324 O 1.823774 6.068641 1.416676 -0.501965 O 1.858378 8.359704 1.366494 -0.522322 O 1.823774 9.335857 13.336827 -0.501962 O 1.858378 8.146867 11.377799 -0.522343 O 8.231974 -6.882102 14.753502 -0.501970 O 8.266578 -5.780030 12.744293 -0.522314 O 8.231974 5.074659 17.884086 -0.501965 O 8.266578 2.783596 17.934268 -0.522351 O 8.231974 1.807443 5.963935 -0.501966 O 8.266578 2.996433 7.922963 -0.522327 O 4.584426 6.882102 14.753502 -0.501964 O 4.549822 5.780030 12.744293 -0.522344 O 4.584426 -5.074659 17.884086 -0.501965 O 4.549822 -2.783596 17.934268 -0.522321 O 4.584426 -1.807443 5.963935 -0.501965 O 4.549822 -2.996433 7.922963 -0.522324 O 10.992626 4.261198 4.547260 -0.501965 O 10.958022 5.363270 6.556469 -0.522326 O 10.992626 16.217959 1.416676 -0.501961 O 10.958022 13.926896 1.366494 -0.522304 O 10.992626 12.950743 13.336827 -0.501974 O 10.958022 14.139733 11.377799 -0.522362 O 10.992626 -6.882102 14.753502 -0.501970 O 10.958022 -5.780030 12.744293 -0.522314 O 10.992626 5.074659 17.884086 -0.501965 O 10.958022 2.783596 17.934268 -0.522351 O 10.992626 1.807443 5.963935 -0.501966 O 10.958022 2.996433 7.922963 -0.522326 O 4.584426 18.025402 4.547260 -0.501968 O 4.549822 16.923330 6.556469 -0.522324 O 4.584426 6.068641 1.416676 -0.501965 O 4.549822 8.359704 1.366494 -0.522322 O 4.584426 9.335857 13.336827 -0.501962 O 4.549822 8.146867 11.377799 -0.522343 O 8.231974 4.261198 4.547260 -0.501965 O 8.266578 5.363270 6.556469 -0.522326 O 8.231974 16.217959 1.416676 -0.501961 O 8.266578 13.926896 1.366494 -0.522304 O 8.231974 12.950743 13.336827 -0.501974 O 8.266578 14.139733 11.377799 -0.522362 O 1.823774 6.882102 14.753502 -0.501964 O 1.858378 5.780030 12.744293 -0.522344 O 1.823774 -5.074659 17.884086 -0.501965 O 1.858378 -2.783596 17.934268 -0.522321 O 1.823774 -1.807443 5.963935 -0.501965 O 1.858378 -2.996433 7.922963 -0.522324 The following XYZ coordinates are in angstroms. Other properties are in atomic units. The sperically averaged electron density of each atom fit to a function of the form exp(a - br) eigen_1, eigen_2 and eigen_3 are the three eigenvalues of traceless quadrupole moment tensor atom number atomic symbol X Y Z net charge C6 coefficient C8 coefficient C10 coefficient fluctuating dipole atomic polarizability isotropic forcefield polarizability a b squared Pearson coefficient wp_QDO m_QDO q_QDO dipole_x dipole_y dipole_z dipole Qxy Qxz Qyz Q(x^2-y^2) Q(3z^2 - R^2) eigen_1 eigen_2 eigen_3 static polarizability alpha(xx) alpha(xy) alpha(xz) alpha(yy) alpha(yz) alpha(zz) atomic spin moment 1 Cu 3.204100 -4.224425 7.316919 0.851354 52.218370 0.74748948E+03 0.18847120E+05 12.131829 9.384849 1.028596 2.264689 0.996053 39.884164 95.866526 0.549776 0.441856 -1.119540 -0.000000 -0.086203 0.149302 0.172401 0.000000 0.000000 0.062140 0.038870 -0.182402 -0.096674 0.046839 0.049835 16.693312 17.263257 0.000001 0.000000 21.093396 8.114721 11.723283 0.664898 2 Cu 3.204100 -2.994205 5.186115 0.812019 51.445702 0.80689207E+03 0.20748911E+05 12.098343 9.835397 1.092470 2.273206 0.995823 40.693257 98.954205 0.529818 0.449572 -1.114095 0.000000 0.092001 -0.159346 0.183998 0.000000 -0.000000 0.054922 0.021596 -0.148464 -0.081193 0.035542 0.045651 15.712932 16.539095 0.000000 0.000000 19.248199 6.838727 11.351503 -0.666775 3 Cu 3.204100 8.448850 0.000000 0.851320 52.221747 0.74754011E+03 0.18848748E+05 12.132425 9.385228 1.028511 2.264655 0.996053 39.884975 95.869907 0.549758 0.441862 -1.119534 0.000000 0.172402 -0.000002 0.172402 0.000000 -0.000000 -0.000006 0.146533 0.140541 -0.096690 0.046847 0.049843 16.694278 17.264198 -0.000000 -0.000001 7.038566 -0.000012 25.780069 0.664820 4 Cu 3.204100 5.988409 0.000000 0.812039 51.442712 0.80684257E+03 0.20747283E+05 12.097783 9.835018 1.092521 2.273227 0.995824 40.692667 98.951357 0.529835 0.449565 -1.114102 0.000000 -0.183999 0.000002 0.183999 -0.000000 -0.000000 -0.000006 0.116698 0.136917 -0.081169 0.035529 0.045639 15.712095 16.538230 -0.000000 -0.000001 7.402873 0.000002 23.195181 -0.666648 5 Cu 3.204100 6.918875 11.983843 0.851622 52.198961 0.74716888E+03 0.18836797E+05 12.128359 9.382385 1.029454 2.265010 0.996057 39.879023 95.844827 0.549894 0.441814 -1.119579 0.000000 -0.086193 -0.149290 0.172385 -0.000000 0.000000 -0.062151 0.038882 -0.182413 -0.096687 0.046844 0.049843 16.688133 17.258140 0.000000 -0.000000 21.086503 -8.111830 11.719755 -0.665419 6 Cu 3.204100 8.149095 14.114647 0.811877 51.454983 0.80706600E+03 0.20754585E+05 12.099950 9.836608 1.092137 2.273070 0.995822 40.696282 98.965723 0.529771 0.449586 -1.114082 0.000000 0.092012 0.159371 0.184025 -0.000000 0.000000 -0.054917 0.021595 -0.148423 -0.081180 0.035535 0.045645 15.715175 16.541359 -0.000000 0.000000 19.251097 -6.839879 11.353068 0.666759 7 Cu 9.612300 -6.918875 11.983843 0.851455 52.211543 0.74737420E+03 0.18843418E+05 12.130644 9.383992 1.028897 2.264804 0.996054 39.882133 95.858468 0.549814 0.441843 -1.119552 0.000000 0.086190 -0.149301 0.172393 -0.000000 -0.000000 0.062156 0.038884 -0.182425 -0.096694 0.046848 0.049846 16.691572 17.261542 -0.000000 -0.000000 21.091097 8.113751 11.722076 -0.664925 8 Cu 9.612300 -8.149095 14.114647 0.811955 51.449280 0.80695883E+03 0.20751090E+05 12.098966 9.835864 1.092305 2.273143 0.995823 40.694400 98.958602 0.529800 0.449578 -1.114090 0.000000 -0.092006 0.159357 0.184010 -0.000000 -0.000000 0.054911 0.021593 -0.148417 -0.081173 0.035533 0.045641 15.713808 16.539983 -0.000000 -0.000000 19.249311 6.839187 11.352129 0.666997 9 Cu 9.612300 13.837750 0.000000 0.851471 52.209905 0.74734897E+03 0.18842595E+05 12.130319 9.383771 1.028997 2.264838 0.996055 39.881900 95.856986 0.549827 0.441838 -1.119557 0.000000 -0.172396 -0.000008 0.172396 -0.000000 0.000000 0.000001 0.146523 0.140527 -0.096683 0.046842 0.049841 16.691059 17.261027 0.000000 0.000000 7.037439 -0.000020 25.774711 -0.664804 10 Cu 9.612300 16.298191 0.000000 0.811966 51.447154 0.80692292E+03 0.20749905E+05 12.098555 9.835580 1.092367 2.273164 0.995823 40.694043 98.956638 0.529813 0.449572 -1.114096 0.000000 0.184017 -0.000001 0.184017 -0.000000 0.000000 -0.000003 0.116688 0.136905 -0.081161 0.035526 0.045635 15.713190 16.539339 -0.000000 0.000000 7.403290 0.000015 23.196940 0.666873 11 Cu 9.612300 4.224425 7.316919 0.851307 52.224424 0.74757900E+03 0.18850005E+05 12.132920 9.385540 1.028436 2.264628 0.996052 39.885473 95.872329 0.549742 0.441868 -1.119528 0.000000 0.086199 0.149301 0.172398 0.000000 -0.000000 -0.062168 0.038888 -0.182460 -0.096712 0.046859 0.049854 16.695076 17.264987 0.000001 -0.000000 21.095778 -8.115777 11.724464 -0.664327 12 Cu 9.612300 2.994205 5.186115 0.812054 51.441009 0.80681774E+03 0.20746469E+05 12.097469 9.834834 1.092485 2.273218 0.995823 40.692387 98.950000 0.529843 0.449562 -1.114104 0.000000 -0.091995 -0.159340 0.183991 0.000000 -0.000000 -0.054909 0.021592 -0.148397 -0.081168 0.035529 0.045639 15.711583 16.537714 0.000000 0.000000 19.246417 -6.837963 11.350616 0.667154 13 H 1.230374 14.694670 6.429084 0.120059 1.629439 0.13659488E+02 0.15079225E+03 2.141024 2.042129 -1.422364 2.171869 0.995537 3.950969 11.116692 0.484616 1.144889 -0.741006 0.028932 0.001650 0.043237 0.052050 -0.001730 0.016258 -0.003153 0.006351 0.031081 -0.013246 -0.008748 0.021993 2.176755 2.061452 0.210158 0.444925 2.083616 -0.075238 2.385199 0.000243 14 H 1.230374 9.363715 3.360263 0.120056 1.629327 0.13658255E+02 0.15077463E+03 2.140891 2.042010 -1.422345 2.171876 0.995537 3.950817 11.115970 0.484642 1.144859 -0.741013 0.028934 0.036621 -0.023047 0.052052 0.014950 -0.006631 -0.006526 -0.010413 -0.019229 -0.013249 -0.008749 0.021997 2.176617 2.061325 0.280211 -0.404423 2.374805 -0.092964 2.093722 0.000245 15 H 1.230374 9.371515 9.511416 0.120056 1.629437 0.13659469E+02 0.15079204E+03 2.141025 2.042130 -1.422381 2.171858 0.995536 3.950982 11.116742 0.484616 1.144891 -0.741005 0.028933 -0.038270 -0.020190 0.052051 -0.013220 -0.009626 0.009681 -0.004949 -0.002839 -0.013248 -0.008748 0.021996 2.176756 2.061452 -0.490395 -0.040461 2.244645 0.168211 2.224173 -0.000255 16 H 7.638574 -3.551370 12.871678 0.120054 1.629457 0.13659678E+02 0.15079489E+03 2.141042 2.042145 -1.422366 2.171867 0.995537 3.950993 11.116785 0.484614 1.144891 -0.741005 0.028932 -0.001650 -0.043237 0.052050 0.001730 -0.016258 -0.003152 0.006349 0.031079 -0.013246 -0.008747 0.021993 2.176774 2.061469 -0.210161 -0.444932 2.083633 -0.075238 2.385221 -0.000245 17 H 7.638574 1.779585 15.940499 0.120062 1.629320 0.13658181E+02 0.15077362E+03 2.140886 2.042005 -1.422360 2.171872 0.995537 3.950800 11.115919 0.484643 1.144859 -0.741013 0.028935 -0.036622 0.023047 0.052054 -0.014950 0.006633 -0.006525 -0.010411 -0.019237 -0.013249 -0.008750 0.021999 2.176612 2.061320 -0.280212 0.404421 2.374801 -0.092965 2.093714 -0.000257 18 H 7.638574 1.771785 9.789346 0.120055 1.629415 0.13659246E+02 0.15078910E+03 2.141014 2.042120 -1.422366 2.171865 0.995537 3.950965 11.116706 0.484614 1.144899 -0.741003 0.028933 0.038269 0.020189 0.052051 0.013217 0.009627 0.009681 -0.004951 -0.002841 -0.013246 -0.008749 0.021995 2.176746 2.061443 0.490392 0.040458 2.244635 0.168206 2.224162 -0.000244 19 H 5.177826 3.551370 12.871678 0.120058 1.629425 0.13659346E+02 0.15079038E+03 2.141018 2.042123 -1.422382 2.171860 0.995536 3.950963 11.116688 0.484615 1.144894 -0.741004 -0.028933 0.001650 -0.043238 0.052052 0.001726 0.016261 0.003154 0.006356 0.031074 -0.013247 -0.008748 0.021996 2.176749 2.061445 -0.210156 0.444922 2.083608 0.075241 2.385193 -0.000255 20 H 5.177826 -1.779585 15.940499 0.120054 1.629457 0.13659685E+02 0.15079507E+03 2.141046 2.042149 -1.422366 2.171866 0.995537 3.951004 11.116839 0.484612 1.144894 -0.741004 -0.028932 0.036619 0.023047 0.052050 -0.014945 -0.006631 0.006528 -0.010416 -0.019221 -0.013246 -0.008747 0.021993 2.176779 2.061473 -0.280242 -0.404473 2.374986 0.092971 2.093878 0.000245 21 H 5.177826 -1.771785 9.789346 0.120059 1.629319 0.13658168E+02 0.15077328E+03 2.140876 2.041996 -1.422342 2.171877 0.995537 3.950800 11.115873 0.484647 1.144850 -0.741016 -0.028934 -0.038270 0.020191 0.052052 0.013218 -0.009632 -0.009681 -0.004949 -0.002836 -0.013249 -0.008749 0.021998 2.176601 2.061310 0.490340 -0.040458 2.244485 -0.168194 2.224007 0.000244 22 H 11.586026 7.591930 6.429084 0.120055 1.629409 0.13659187E+02 0.15078827E+03 2.141009 2.042116 -1.422363 2.171867 0.995537 3.950956 11.116672 0.484614 1.144899 -0.741003 -0.028933 -0.001650 0.043237 0.052051 -0.001729 -0.016260 0.003153 0.006354 0.031077 -0.013246 -0.008749 0.021995 2.176741 2.061438 0.210157 -0.444920 2.083604 0.075238 2.385181 -0.000243 23 H 11.586026 12.922885 3.360263 0.120058 1.629453 0.13659634E+02 0.15079431E+03 2.141039 2.042142 -1.422361 2.171869 0.995537 3.950988 11.116772 0.484614 1.144891 -0.741005 -0.028931 -0.036620 -0.023047 0.052050 0.014945 0.006631 0.006527 -0.010417 -0.019216 -0.013247 -0.008746 0.021993 2.176771 2.061466 0.280241 0.404469 2.374979 0.092972 2.093868 -0.000246 24 H 11.586026 12.915085 9.511416 0.120059 1.629329 0.13658268E+02 0.15077482E+03 2.140894 2.042012 -1.422367 2.171868 0.995537 3.950813 11.115964 0.484642 1.144859 -0.741013 -0.028936 0.038270 -0.020191 0.052054 -0.013219 0.009630 -0.009682 -0.004943 -0.002835 -0.013248 -0.008750 0.021999 2.176620 2.061327 -0.490348 0.040459 2.244505 -0.168197 2.224026 -0.000256 25 H 11.586026 -3.551370 12.871678 0.120054 1.629457 0.13659678E+02 0.15079490E+03 2.141042 2.042145 -1.422366 2.171867 0.995537 3.950993 11.116786 0.484614 1.144891 -0.741005 -0.028932 -0.001650 -0.043237 0.052050 -0.001730 0.016258 -0.003152 0.006349 0.031079 -0.013246 -0.008747 0.021993 2.176775 2.061469 0.210161 0.444932 2.083634 -0.075238 2.385221 -0.000245 26 H 11.586026 1.779585 15.940499 0.120062 1.629320 0.13658184E+02 0.15077367E+03 2.140887 2.042006 -1.422360 2.171872 0.995537 3.950800 11.115921 0.484642 1.144860 -0.741013 -0.028935 -0.036622 0.023047 0.052054 0.014950 -0.006633 -0.006525 -0.010411 -0.019237 -0.013249 -0.008750 0.021999 2.176612 2.061320 0.280212 -0.404421 2.374802 -0.092965 2.093714 -0.000257 27 H 11.586026 1.771785 9.789346 0.120055 1.629415 0.13659246E+02 0.15078910E+03 2.141014 2.042120 -1.422366 2.171865 0.995537 3.950965 11.116706 0.484614 1.144899 -0.741003 -0.028933 0.038269 0.020189 0.052051 -0.013217 -0.009627 0.009681 -0.004951 -0.002841 -0.013246 -0.008749 0.021995 2.176746 2.061443 -0.490392 -0.040458 2.244635 0.168206 2.224162 -0.000244 28 H 5.177826 14.694670 6.429084 0.120059 1.629439 0.13659492E+02 0.15079230E+03 2.141024 2.042129 -1.422364 2.171869 0.995537 3.950970 11.116693 0.484617 1.144888 -0.741006 -0.028932 0.001650 0.043237 0.052050 0.001730 -0.016258 -0.003153 0.006351 0.031081 -0.013246 -0.008748 0.021993 2.176755 2.061451 -0.210158 -0.444925 2.083615 -0.075238 2.385199 0.000243 29 H 5.177826 9.363715 3.360263 0.120056 1.629327 0.13658254E+02 0.15077462E+03 2.140891 2.042010 -1.422345 2.171876 0.995537 3.950817 11.115969 0.484642 1.144858 -0.741013 -0.028934 0.036621 -0.023047 0.052052 -0.014950 0.006631 -0.006526 -0.010413 -0.019229 -0.013249 -0.008749 0.021997 2.176617 2.061325 -0.280211 0.404423 2.374805 -0.092964 2.093722 0.000245 30 H 5.177826 9.371515 9.511416 0.120056 1.629437 0.13659473E+02 0.15079211E+03 2.141026 2.042130 -1.422382 2.171858 0.995536 3.950982 11.116744 0.484615 1.144891 -0.741005 -0.028933 -0.038270 -0.020190 0.052051 0.013220 0.009626 0.009681 -0.004949 -0.002839 -0.013248 -0.008748 0.021996 2.176757 2.061453 0.490395 0.040461 2.244646 0.168211 2.224173 -0.000255 31 H 7.638574 7.591930 6.429084 0.120055 1.629409 0.13659189E+02 0.15078829E+03 2.141009 2.042116 -1.422364 2.171867 0.995537 3.950956 11.116672 0.484614 1.144899 -0.741003 0.028933 -0.001650 0.043237 0.052051 0.001729 0.016260 0.003153 0.006354 0.031077 -0.013246 -0.008749 0.021995 2.176741 2.061438 -0.210157 0.444920 2.083604 0.075238 2.385182 -0.000243 32 H 7.638574 12.922885 3.360263 0.120058 1.629453 0.13659636E+02 0.15079434E+03 2.141039 2.042142 -1.422362 2.171869 0.995537 3.950988 11.116773 0.484614 1.144891 -0.741005 0.028931 -0.036620 -0.023047 0.052050 -0.014945 -0.006631 0.006527 -0.010417 -0.019216 -0.013247 -0.008746 0.021993 2.176771 2.061466 -0.280242 -0.404469 2.374979 0.092972 2.093868 -0.000246 33 H 7.638574 12.915085 9.511416 0.120058 1.629329 0.13658271E+02 0.15077486E+03 2.140895 2.042012 -1.422367 2.171868 0.995537 3.950813 11.115965 0.484641 1.144860 -0.741013 0.028936 0.038270 -0.020191 0.052054 0.013219 -0.009630 -0.009682 -0.004943 -0.002835 -0.013248 -0.008750 0.021999 2.176620 2.061328 0.490349 -0.040459 2.244506 -0.168197 2.224027 -0.000256 34 H 1.230374 3.551370 12.871678 0.120058 1.629425 0.13659348E+02 0.15079043E+03 2.141018 2.042124 -1.422382 2.171860 0.995536 3.950963 11.116690 0.484615 1.144895 -0.741004 0.028933 0.001650 -0.043238 0.052052 -0.001727 -0.016261 0.003154 0.006356 0.031074 -0.013247 -0.008748 0.021996 2.176749 2.061445 0.210156 -0.444923 2.083609 0.075241 2.385193 -0.000255 35 H 1.230374 -1.779585 15.940499 0.120054 1.629457 0.13659685E+02 0.15079507E+03 2.141046 2.042149 -1.422366 2.171866 0.995537 3.951004 11.116839 0.484612 1.144894 -0.741004 0.028932 0.036619 0.023047 0.052050 0.014945 0.006631 0.006528 -0.010416 -0.019221 -0.013246 -0.008747 0.021993 2.176779 2.061473 0.280242 0.404473 2.374986 0.092971 2.093878 0.000245 36 H 1.230374 -1.771785 9.789346 0.120059 1.629320 0.13658172E+02 0.15077334E+03 2.140876 2.041996 -1.422343 2.171877 0.995537 3.950801 11.115875 0.484647 1.144850 -0.741016 0.028934 -0.038270 0.020191 0.052052 -0.013218 0.009632 -0.009681 -0.004949 -0.002836 -0.013249 -0.008749 0.021998 2.176601 2.061310 -0.490340 0.040458 2.244485 -0.168194 2.224007 0.000244 37 H 0.000000 17.033091 3.033115 0.132725 1.665082 0.13833151E+02 0.15198422E+03 2.126979 2.023518 -1.405540 2.198187 0.994606 3.719145 10.172984 0.502232 1.110004 -0.752697 0.000000 0.049912 -0.028816 0.057633 0.001087 0.001884 -0.012992 -0.032449 0.002444 -0.017087 -0.006231 0.023318 2.136628 1.813097 0.114166 0.197740 2.495159 -0.340806 2.101629 -0.000003 38 H 0.000000 5.253509 3.033115 0.132726 1.665039 0.13832694E+02 0.15197759E+03 2.126915 2.023463 -1.405546 2.198183 0.994606 3.719122 10.172790 0.502248 1.109980 -0.752703 -0.000000 -0.049911 -0.028816 0.057632 0.001088 -0.001884 0.012993 -0.032450 0.002447 -0.017088 -0.006231 0.023319 2.136562 1.813049 0.114159 -0.197730 2.495071 0.340788 2.101566 -0.000005 39 H 0.000000 11.143300 13.234533 0.132730 1.665074 0.13833103E+02 0.15198357E+03 2.126968 2.023511 -1.405564 2.198175 0.994606 3.719159 10.173023 0.502234 1.110000 -0.752697 -0.000000 0.000001 0.057628 0.057628 -0.002175 0.000000 0.000000 -0.009941 0.069962 -0.017086 -0.006235 0.023321 2.136616 1.813093 -0.228330 -0.000001 1.904860 0.000001 2.691896 0.000527 40 H 6.408200 -5.889791 16.267647 0.132724 1.665059 0.13832897E+02 0.15198053E+03 2.126945 2.023489 -1.405544 2.198186 0.994606 3.719129 10.172867 0.502240 1.109991 -0.752700 0.000000 -0.049911 0.028816 0.057633 -0.001087 -0.001883 -0.012993 -0.032449 0.002446 -0.017087 -0.006231 0.023318 2.136593 1.813071 -0.114163 -0.197734 2.495115 -0.340797 2.101594 -0.000006 41 H 6.408200 5.889791 16.267647 0.132733 1.665048 0.13832814E+02 0.15197946E+03 2.126936 2.023482 -1.405552 2.198180 0.994606 3.719128 10.172873 0.502241 1.109991 -0.752700 0.000000 0.049907 0.028815 0.057628 -0.001087 0.001884 0.012995 -0.032449 0.002438 -0.017086 -0.006235 0.023321 2.136584 1.813067 -0.114162 0.197734 2.495097 0.340790 2.101587 0.000529 42 H 6.408200 0.000000 6.066229 0.132725 1.665088 0.13833233E+02 0.15198533E+03 2.126980 2.023521 -1.405553 2.198180 0.994605 3.719169 10.173055 0.502233 1.110000 -0.752697 -0.000000 -0.000000 -0.057632 0.057632 0.002176 -0.000000 0.000000 -0.009946 0.069955 -0.017087 -0.006231 0.023318 2.136628 1.813100 0.228332 0.000001 1.904868 0.000002 2.691917 -0.000003 43 H 0.000000 -5.889791 16.267647 0.132724 1.665059 0.13832902E+02 0.15198060E+03 2.126946 2.023489 -1.405544 2.198185 0.994606 3.719129 10.172869 0.502240 1.109992 -0.752700 0.000000 -0.049911 0.028816 0.057633 0.001087 0.001883 -0.012993 -0.032449 0.002446 -0.017087 -0.006231 0.023318 2.136594 1.813071 0.114163 0.197735 2.495116 -0.340797 2.101595 -0.000006 44 H 0.000000 5.889791 16.267647 0.132733 1.665048 0.13832816E+02 0.15197948E+03 2.126936 2.023483 -1.405552 2.198180 0.994606 3.719128 10.172874 0.502241 1.109991 -0.752700 -0.000000 0.049907 0.028815 0.057628 0.001087 -0.001884 0.012995 -0.032449 0.002438 -0.017086 -0.006235 0.023321 2.136584 1.813067 0.114162 -0.197734 2.495098 0.340791 2.101587 0.000529 45 H 0.000000 0.000000 6.066229 0.132724 1.665089 0.13833241E+02 0.15198544E+03 2.126981 2.023522 -1.405553 2.198180 0.994605 3.719170 10.173058 0.502233 1.110000 -0.752697 0.000000 -0.000000 -0.057632 0.057632 -0.002176 0.000000 0.000000 -0.009946 0.069955 -0.017087 -0.006231 0.023318 2.136629 1.813101 -0.228332 -0.000001 1.904869 0.000002 2.691918 -0.000003 46 H 6.408200 17.033091 3.033115 0.132725 1.665082 0.13833148E+02 0.15198418E+03 2.126979 2.023519 -1.405540 2.198188 0.994606 3.719144 10.172982 0.502232 1.110004 -0.752697 -0.000000 0.049912 -0.028816 0.057633 -0.001087 -0.001884 -0.012992 -0.032449 0.002444 -0.017087 -0.006231 0.023318 2.136628 1.813097 -0.114166 -0.197740 2.495159 -0.340806 2.101629 -0.000003 47 H 6.408200 5.253509 3.033115 0.132726 1.665040 0.13832704E+02 0.15197772E+03 2.126916 2.023464 -1.405546 2.198183 0.994606 3.719123 10.172794 0.502248 1.109980 -0.752703 0.000000 -0.049911 -0.028816 0.057632 -0.001088 0.001884 0.012993 -0.032450 0.002447 -0.017088 -0.006231 0.023319 2.136563 1.813049 -0.114159 0.197730 2.495072 0.340788 2.101566 -0.000005 48 H 6.408200 11.143300 13.234533 0.132730 1.665074 0.13833098E+02 0.15198350E+03 2.126967 2.023511 -1.405563 2.198175 0.994606 3.719159 10.173021 0.502234 1.110000 -0.752697 0.000000 0.000001 0.057628 0.057628 0.002175 -0.000000 0.000000 -0.009941 0.069962 -0.017086 -0.006235 0.023321 2.136616 1.813093 0.228330 0.000001 1.904859 0.000001 2.691895 0.000527 49 H 0.000000 11.143300 3.948936 0.107470 1.668974 0.14064744E+02 0.15608264E+03 2.151347 2.052525 -1.408421 2.165441 0.995987 4.030942 11.295103 0.491368 1.123250 -0.746087 0.000001 -0.000001 -0.048341 0.048341 0.004600 0.000001 0.000000 -0.013936 0.064217 -0.019052 -0.002353 0.021406 2.180582 1.669560 -0.162118 0.000000 2.139702 -0.000002 2.732483 0.000000 50 H 0.000000 8.991529 7.675913 0.107468 1.669030 0.14065397E+02 0.15609230E+03 2.151431 2.052601 -1.408440 2.165432 0.995987 4.031036 11.295599 0.491347 1.123281 -0.746079 -0.000001 -0.041865 0.024170 0.048341 -0.002300 -0.003984 -0.010886 -0.032793 0.007653 -0.019053 -0.002352 0.021406 2.180669 1.669616 0.081065 0.140407 2.584396 -0.256692 2.287994 0.000014 51 H 0.000000 13.295071 7.675913 0.107470 1.668976 0.14064775E+02 0.15608305E+03 2.151348 2.052526 -1.408416 2.165443 0.995988 4.030944 11.295107 0.491368 1.123249 -0.746087 -0.000001 0.041865 0.024170 0.048341 -0.002299 0.003984 0.010886 -0.032791 0.007651 -0.019052 -0.002353 0.021406 2.180583 1.669561 0.081060 -0.140398 2.584291 0.256681 2.287896 -0.000003 52 H 6.408200 0.000000 15.351826 0.107469 1.668989 0.14064912E+02 0.15608501E+03 2.151362 2.052539 -1.408420 2.165440 0.995987 4.030964 11.295194 0.491366 1.123252 -0.746086 0.000000 -0.000001 0.048341 0.048341 -0.004600 -0.000001 -0.000000 -0.013936 0.064216 -0.019052 -0.002353 0.021405 2.180598 1.669570 0.162120 -0.000001 2.139718 -0.000004 2.732505 -0.000002 53 H 6.408200 2.151771 11.624849 0.107468 1.669040 0.14065503E+02 0.15609378E+03 2.151439 2.052608 -1.408439 2.165431 0.995987 4.031051 11.295652 0.491346 1.123280 -0.746079 0.000001 0.041864 -0.024171 0.048340 0.002300 0.003984 -0.010886 -0.032794 0.007655 -0.019054 -0.002352 0.021406 2.180677 1.669621 -0.081064 -0.140409 2.584405 -0.256694 2.288004 0.000013 54 H 6.408200 -2.151771 11.624849 0.107472 1.668951 0.14064501E+02 0.15607919E+03 2.151324 2.052504 -1.408417 2.165445 0.995987 4.030907 11.294960 0.491372 1.123247 -0.746088 -0.000000 -0.041864 -0.024171 0.048341 0.002300 -0.003984 0.010886 -0.032791 0.007651 -0.019052 -0.002354 0.021406 2.180558 1.669545 -0.081058 0.140396 2.584260 0.256677 2.287869 -0.000001 55 H 0.000000 0.000000 15.351826 0.107469 1.668989 0.14064908E+02 0.15608495E+03 2.151362 2.052538 -1.408420 2.165440 0.995987 4.030964 11.295193 0.491366 1.123251 -0.746086 -0.000000 -0.000001 0.048341 0.048341 0.004600 0.000001 -0.000000 -0.013936 0.064216 -0.019052 -0.002353 0.021405 2.180597 1.669570 -0.162120 0.000001 2.139717 -0.000004 2.732504 -0.000002 56 H 0.000000 2.151771 11.624849 0.107468 1.669039 0.14065501E+02 0.15609374E+03 2.151438 2.052608 -1.408439 2.165431 0.995987 4.031051 11.295651 0.491346 1.123280 -0.746079 -0.000001 0.041863 -0.024171 0.048340 -0.002300 -0.003984 -0.010886 -0.032794 0.007655 -0.019054 -0.002352 0.021406 2.180676 1.669621 0.081064 0.140409 2.584405 -0.256694 2.288004 0.000013 57 H 0.000000 -2.151771 11.624849 0.107472 1.668951 0.14064502E+02 0.15607920E+03 2.151324 2.052505 -1.408417 2.165445 0.995987 4.030907 11.294961 0.491372 1.123247 -0.746088 0.000000 -0.041864 -0.024171 0.048341 -0.002300 0.003984 0.010886 -0.032791 0.007651 -0.019052 -0.002354 0.021406 2.180558 1.669545 0.081058 -0.140396 2.584260 0.256677 2.287869 -0.000001 58 H 6.408200 11.143300 3.948936 0.107470 1.668974 0.14064743E+02 0.15608262E+03 2.151346 2.052524 -1.408421 2.165441 0.995987 4.030942 11.295101 0.491368 1.123249 -0.746087 -0.000001 -0.000001 -0.048341 0.048341 -0.004600 -0.000001 0.000000 -0.013936 0.064217 -0.019052 -0.002353 0.021406 2.180581 1.669560 0.162118 -0.000000 2.139702 -0.000002 2.732482 0.000000 59 H 6.408200 8.991529 7.675913 0.107468 1.669030 0.14065396E+02 0.15609229E+03 2.151431 2.052601 -1.408440 2.165432 0.995987 4.031036 11.295598 0.491347 1.123281 -0.746079 0.000001 -0.041865 0.024170 0.048341 0.002300 0.003984 -0.010886 -0.032793 0.007653 -0.019053 -0.002352 0.021406 2.180668 1.669616 -0.081065 -0.140407 2.584396 -0.256692 2.287994 0.000014 60 H 6.408200 13.295071 7.675913 0.107470 1.668976 0.14064768E+02 0.15608295E+03 2.151348 2.052526 -1.408415 2.165443 0.995988 4.030943 11.295104 0.491368 1.123249 -0.746087 0.000001 0.041865 0.024170 0.048341 0.002299 -0.003984 0.010886 -0.032791 0.007651 -0.019052 -0.002353 0.021406 2.180583 1.669561 -0.081059 0.140398 2.584291 0.256681 2.287896 -0.000003 61 C 0.671579 14.754844 5.494927 -0.123211 39.612988 0.49134859E+03 0.11878346E+05 10.058089 7.358944 0.071835 1.985513 0.999578 30.078453 86.915061 0.613010 0.413307 -1.069083 -0.010635 0.017102 -0.019159 0.027797 -0.017155 -0.016676 0.009064 0.055228 0.038552 -0.039300 0.000091 0.039209 12.247500 8.733580 4.988078 2.393319 18.795334 -0.822531 9.213586 -0.000484 62 C 1.505927 17.074879 5.332801 0.575267 24.608660 0.27189021E+03 0.57341264E+04 7.894013 5.852734 -0.029689 2.042532 0.999703 22.618365 63.364303 0.614720 0.472449 -1.022196 0.021763 0.039613 0.022863 0.050652 -0.098264 -0.045631 0.006753 0.062274 -0.074853 -0.097724 -0.028969 0.126693 10.164005 9.139503 5.766619 3.098718 12.840452 2.824143 8.512061 0.000323 63 C 0.681832 15.965006 4.788519 -0.019720 42.051812 0.43553102E+03 0.10164510E+05 10.474630 6.901777 -0.050531 1.984478 0.999147 27.326400 76.307273 0.639889 0.410142 -1.076595 -0.022544 -0.030837 -0.014423 0.040831 0.000395 -0.013068 0.007770 0.004898 0.015430 -0.014203 -0.003186 0.017390 14.444451 12.693242 7.221900 6.326721 17.871362 3.023250 12.768747 -0.001339 64 C 0.671579 8.524624 3.775229 -0.123217 39.613111 0.49135053E+03 0.11878398E+05 10.058109 7.358962 0.071829 1.985509 0.999578 30.078456 86.914928 0.613009 0.413307 -1.069083 -0.010634 -0.025144 -0.005229 0.027797 -0.005858 0.023193 -0.024835 0.027910 -0.043407 -0.039301 0.000097 0.039204 12.247540 8.733591 -0.421421 -5.516484 12.321367 4.560364 15.687663 -0.000484 65 C 1.505927 7.224201 1.847083 0.575266 24.608855 0.27189163E+03 0.57341673E+04 7.894083 5.852765 -0.029690 2.042531 0.999703 22.618409 63.364616 0.614715 0.472452 -1.022194 0.021765 -0.000008 -0.045738 0.050653 0.009615 0.107916 -0.000652 0.072838 -0.043160 -0.097725 -0.028968 0.126693 10.164138 9.139637 -0.199721 -6.543524 7.148429 0.462144 14.204349 0.000324 66 C 0.681832 7.307776 3.080402 -0.019724 42.052477 0.43553669E+03 0.10164688E+05 10.474777 6.901844 -0.050553 1.984469 0.999147 27.326610 76.308331 0.639882 0.410144 -1.076592 -0.022544 0.002928 0.033918 0.040832 -0.011512 0.006188 -0.008284 0.004003 0.012753 -0.014202 -0.003182 0.017384 14.444719 12.693515 1.868185 -9.417971 11.426284 0.697835 19.214359 -0.001338 67 C 0.671579 10.150432 10.030606 -0.123195 39.612705 0.49134471E+03 0.11878237E+05 10.058073 7.358939 0.071809 1.985507 0.999578 30.078289 86.914736 0.613006 0.413309 -1.069080 -0.010650 0.008038 0.024389 0.027801 0.023023 -0.006520 0.015775 0.012218 -0.090507 -0.039305 0.000090 0.039215 12.247460 8.733537 -4.566664 3.123086 10.896611 -3.737667 17.112233 -0.000288 68 C 1.505927 9.130820 12.120879 0.575280 24.608611 0.27188951E+03 0.57341111E+04 7.894028 5.852745 -0.029733 2.042519 0.999703 22.618293 63.364210 0.614716 0.472452 -1.022194 0.021764 -0.039619 0.022856 0.050654 0.088652 -0.062282 -0.006094 0.061142 -0.078225 -0.097729 -0.028960 0.126689 10.164020 9.139529 -5.566870 3.444696 12.039918 -3.286326 9.312614 -0.000516 69 C 0.681832 10.157118 11.431841 -0.019723 42.052337 0.43553618E+03 0.10164674E+05 10.474750 6.901840 -0.050568 1.984464 0.999147 27.326588 76.308278 0.639882 0.410144 -1.076591 -0.022553 0.027898 -0.019488 0.040826 0.011121 0.006880 0.000510 -0.009443 -0.027595 -0.014204 -0.003179 0.017383 14.444625 12.693416 -9.090187 3.090974 16.662829 -3.721103 13.977629 0.000577 70 C 7.079779 -3.611544 13.805835 -0.123217 39.613136 0.49135075E+03 0.11878413E+05 10.058114 7.358960 0.071836 1.985512 0.999578 30.078544 86.915426 0.613009 0.413307 -1.069083 -0.010635 -0.017101 0.019161 0.027797 0.017154 0.016673 0.009064 0.055228 0.038557 -0.039300 0.000094 0.039206 12.247531 8.733611 -4.988083 -2.393345 18.795353 -0.822525 9.213629 0.000483 71 C 7.914127 -5.931579 13.967961 0.575265 24.608701 0.27189060E+03 0.57341371E+04 7.894031 5.852745 -0.029691 2.042532 0.999703 22.618348 63.364281 0.614718 0.472450 -1.022195 0.021763 -0.039612 -0.022870 0.050653 0.098264 0.045635 0.006754 0.062274 -0.074847 -0.097725 -0.028968 0.126693 10.164038 9.139530 -5.766645 -3.098722 12.840511 2.824154 8.512072 -0.000324 72 C 7.090032 -4.821706 14.512243 -0.019722 42.051861 0.43553148E+03 0.10164525E+05 10.474644 6.901783 -0.050529 1.984478 0.999147 27.326419 76.307383 0.639888 0.410142 -1.076594 -0.022543 0.030836 0.014424 0.040831 -0.000396 0.013067 0.007772 0.004895 0.015430 -0.014205 -0.003184 0.017388 14.444480 12.693276 -7.221913 -6.326753 17.871374 3.023277 12.768789 0.001325 73 C 7.079779 2.618676 15.525533 -0.123189 39.612172 0.49133767E+03 0.11878006E+05 10.057959 7.358871 0.071806 1.985508 0.999578 30.077987 86.913212 0.613012 0.413308 -1.069083 -0.010648 0.025140 0.005235 0.027799 0.005863 -0.023203 -0.024835 0.027920 -0.043416 -0.039306 0.000088 0.039217 12.247322 8.733431 0.421398 5.516340 12.321200 4.560277 15.687334 -0.000290 74 C 7.914127 3.919099 17.453679 0.575274 24.608748 0.27189085E+03 0.57341482E+04 7.894066 5.852764 -0.029734 2.042517 0.999703 22.618375 63.364558 0.614714 0.472453 -1.022193 0.021764 -0.000008 0.045738 0.050652 -0.009616 -0.107913 -0.000648 0.072829 -0.043171 -0.097726 -0.028962 0.126688 10.164082 9.139589 0.199734 6.543458 7.148422 0.462165 14.204236 -0.000512 75 C 7.090032 3.835524 16.220360 -0.019717 42.052119 0.43553344E+03 0.10164589E+05 10.474705 6.901811 -0.050580 1.984462 0.999147 27.326496 76.307842 0.639885 0.410144 -1.076592 -0.022553 -0.002930 -0.033904 0.040825 0.011517 -0.006193 -0.008273 0.004004 0.012740 -0.014200 -0.003182 0.017382 14.444572 12.693379 -1.868182 9.417827 11.426231 0.697833 19.214105 0.000590 76 C 7.079779 0.992868 9.270156 -0.123215 39.613183 0.49135123E+03 0.11878429E+05 10.058131 7.358971 0.071836 1.985512 0.999578 30.078525 86.915435 0.613007 0.413308 -1.069082 -0.010632 -0.008044 -0.024391 0.027797 -0.023016 0.006518 0.015772 0.012213 -0.090505 -0.039301 0.000093 0.039208 12.247565 8.733620 4.566737 -3.123152 10.896736 -3.737754 17.112339 0.000483 77 C 7.914127 2.012480 7.179883 0.575265 24.608748 0.27189088E+03 0.57341452E+04 7.894045 5.852749 -0.029692 2.042532 0.999703 22.618366 63.364370 0.614718 0.472451 -1.022195 0.021766 0.039606 -0.022876 0.050653 -0.088651 0.062284 -0.006101 0.061143 -0.078244 -0.097724 -0.028969 0.126694 10.164070 9.139577 5.566952 -3.444682 12.040060 -3.286324 9.312573 -0.000318 78 C 7.090032 0.986182 7.868921 -0.019722 42.052268 0.43553488E+03 0.10164633E+05 10.474735 6.901826 -0.050539 1.984474 0.999147 27.326538 76.308023 0.639884 0.410144 -1.076592 -0.022542 -0.027910 0.019495 0.040831 -0.011118 -0.006876 0.000515 -0.009453 -0.027626 -0.014203 -0.003185 0.017387 14.444637 12.693437 9.090230 -3.090984 16.662891 -3.721118 13.977582 0.001343 79 C 5.736621 3.611544 13.805835 -0.123191 39.612451 0.49134163E+03 0.11878140E+05 10.058026 7.358912 0.071815 1.985511 0.999578 30.078161 86.914199 0.613008 0.413309 -1.069081 0.010650 0.017102 0.019154 0.027800 0.017159 -0.016681 -0.009063 0.055239 0.038548 -0.039305 0.000087 0.039218 12.247399 8.733489 -4.987978 2.393282 18.795159 0.822604 9.213548 -0.000288 80 C 4.902273 5.931579 13.967961 0.575280 24.608574 0.27188913E+03 0.57341005E+04 7.894014 5.852737 -0.029734 2.042518 0.999703 22.618291 63.364173 0.614717 0.472452 -1.022194 -0.021763 0.039604 -0.022884 0.050654 0.098264 -0.045634 -0.006747 0.062270 -0.074843 -0.097728 -0.028961 0.126689 10.163996 9.139499 -5.766610 3.098685 12.840460 -2.824107 8.512028 -0.000516 81 C 5.726368 4.821706 14.512243 -0.019719 42.052064 0.43553346E+03 0.10164590E+05 10.474693 6.901811 -0.050563 1.984467 0.999147 27.326492 76.307824 0.639885 0.410143 -1.076593 0.022553 -0.030826 0.014416 0.040825 -0.000396 -0.013072 -0.007764 0.004889 0.015398 -0.014204 -0.003181 0.017384 14.444533 12.693326 -7.221914 6.326785 17.871411 -3.023259 12.768862 0.000577 82 C 5.736621 -2.618675 15.525533 -0.123216 39.613247 0.49135184E+03 0.11878450E+05 10.058147 7.358978 0.071827 1.985509 0.999578 30.078577 86.915671 0.613007 0.413308 -1.069081 0.010634 -0.025145 0.005230 0.027798 0.005863 0.023192 0.024836 0.027909 -0.043404 -0.039300 0.000093 0.039206 12.247583 8.733646 0.421355 -5.516514 12.321432 -4.560299 15.687672 -0.000483 83 C 4.902273 -3.919099 17.453679 0.575266 24.608727 0.27189077E+03 0.57341424E+04 7.894041 5.852748 -0.029688 2.042533 0.999703 22.618359 63.364351 0.614717 0.472451 -1.022195 -0.021764 -0.000008 0.045738 0.050652 -0.009615 0.107916 0.000653 0.072838 -0.043158 -0.097725 -0.028968 0.126693 10.164058 9.139554 0.199727 -6.543445 7.148401 -0.462159 14.204218 0.000324 84 C 5.726368 -3.835524 16.220360 -0.019724 42.052071 0.43553335E+03 0.10164584E+05 10.474690 6.901806 -0.050533 1.984476 0.999147 27.326480 76.307700 0.639886 0.410143 -1.076593 0.022543 0.002928 -0.033918 0.040831 0.011514 0.006190 0.008285 0.004004 0.012750 -0.014203 -0.003184 0.017387 14.444556 12.693349 -1.868196 -9.417796 11.426260 -0.697831 19.214059 -0.001340 85 C 5.736621 -0.992868 9.270156 -0.123217 39.613077 0.49135026E+03 0.11878386E+05 10.058093 7.358953 0.071830 1.985509 0.999578 30.078458 86.914836 0.613010 0.413306 -1.069084 0.010635 0.008043 -0.024391 0.027797 -0.023015 -0.006523 -0.015773 0.012212 -0.090498 -0.039301 0.000097 0.039204 12.247509 8.733570 4.566685 3.123192 10.896664 3.737814 17.112295 -0.000485 86 C 4.902273 -2.012480 7.179883 0.575268 24.608821 0.27189144E+03 0.57341616E+04 7.894067 5.852757 -0.029691 2.042531 0.999703 22.618416 63.364597 0.614717 0.472451 -1.022195 -0.021764 -0.039607 -0.022875 0.050652 -0.088650 -0.062284 0.006099 0.061144 -0.078242 -0.097725 -0.028967 0.126692 10.164107 9.139613 5.566972 3.444718 12.040086 3.286361 9.312622 0.000324 87 C 5.726368 -0.986182 7.868921 -0.019724 42.052509 0.43553746E+03 0.10164709E+05 10.474777 6.901847 -0.050556 1.984467 0.999147 27.326631 76.308371 0.639883 0.410144 -1.076592 0.022545 0.027910 0.019495 0.040832 -0.011116 0.006876 -0.000515 -0.009456 -0.027620 -0.014202 -0.003183 0.017385 14.444708 12.693502 9.090273 3.091091 16.662956 3.721247 13.977666 -0.001337 88 C 12.144821 7.531756 5.494927 -0.123215 39.613159 0.49135139E+03 0.11878433E+05 10.058127 7.358972 0.071836 1.985512 0.999578 30.078514 86.915389 0.613007 0.413308 -1.069082 0.010633 -0.017102 -0.019162 0.027797 -0.017153 0.016674 -0.009064 0.055232 0.038551 -0.039301 0.000093 0.039208 12.247559 8.733618 4.988096 -2.393335 18.795415 0.822549 9.213642 0.000484 89 C 11.310473 5.211721 5.332801 0.575266 24.608787 0.27189116E+03 0.57341514E+04 7.894052 5.852751 -0.029692 2.042531 0.999703 22.618359 63.364312 0.614718 0.472451 -1.022195 -0.021765 -0.039614 0.022862 0.050653 -0.098265 0.045632 -0.006753 0.062273 -0.074856 -0.097724 -0.028969 0.126694 10.164086 9.139586 5.766671 -3.098787 12.840515 -2.824210 8.512157 -0.000318 90 C 12.134568 6.321594 4.788519 -0.019723 42.052243 0.43553463E+03 0.10164625E+05 10.474729 6.901822 -0.050540 1.984474 0.999147 27.326533 76.307987 0.639884 0.410144 -1.076592 0.022543 0.030838 -0.014423 0.040831 0.000396 0.013066 -0.007770 0.004897 0.015426 -0.014203 -0.003185 0.017387 14.444633 12.693437 7.221997 -6.326881 17.871489 -3.023362 12.768973 0.001343 91 C 12.144821 13.761975 3.775229 -0.123217 39.613195 0.49135189E+03 0.11878446E+05 10.058117 7.358965 0.071838 1.985512 0.999578 30.078598 86.915585 0.613009 0.413306 -1.069083 0.010637 0.025143 -0.005229 0.027797 -0.005862 -0.023193 0.024837 0.027903 -0.043405 -0.039300 0.000095 0.039205 12.247522 8.733597 -0.421342 5.516453 12.321411 -4.560277 15.687559 0.000483 92 C 11.310473 15.062399 1.847083 0.575269 24.608759 0.27189171E+03 0.57341639E+04 7.894031 5.852751 -0.029687 2.042532 0.999703 22.618355 63.364234 0.614719 0.472450 -1.022196 -0.021763 -0.000000 -0.045740 0.050653 0.009611 -0.107918 0.000656 0.072835 -0.043162 -0.097728 -0.028965 0.126693 10.164018 9.139509 -0.199749 6.543390 7.148401 -0.462189 14.204143 -0.000324 93 C 12.134568 14.978824 3.080402 -0.019724 42.051925 0.43553325E+03 0.10164573E+05 10.474631 6.901784 -0.050519 1.984480 0.999147 27.326498 76.307538 0.639890 0.410141 -1.076596 0.022545 -0.002927 0.033918 0.040832 -0.011514 -0.006187 0.008286 0.004001 0.012763 -0.014206 -0.003180 0.017386 14.444427 12.693218 1.868182 9.417658 11.426222 -0.697849 19.213841 0.001325 94 C 12.144821 12.136168 10.030606 -0.123189 39.612123 0.49133646E+03 0.11877971E+05 10.057959 7.358866 0.071805 1.985508 0.999578 30.077945 86.913110 0.613012 0.413308 -1.069083 0.010646 -0.008036 0.024390 0.027799 0.023026 0.006523 -0.015771 0.012226 -0.090512 -0.039306 0.000087 0.039218 12.247333 8.733447 -4.566613 -3.123126 10.896511 3.737734 17.112040 -0.000290 95 C 11.310473 13.155780 12.120879 0.575271 24.608651 0.27188948E+03 0.57341158E+04 7.894059 5.852756 -0.029737 2.042517 0.999703 22.618376 63.364673 0.614713 0.472454 -1.022192 -0.021764 0.039614 0.022862 0.050652 0.088646 0.062284 0.006100 0.061147 -0.078223 -0.097723 -0.028965 0.126688 10.164087 9.139602 -5.566950 -3.444712 12.040043 3.286349 9.312615 -0.000512 96 C 12.134568 12.129482 11.431841 -0.019714 42.052089 0.43553214E+03 0.10164556E+05 10.474727 6.901815 -0.050589 1.984461 0.999147 27.326421 76.307728 0.639882 0.410145 -1.076591 0.022552 -0.027896 -0.019489 0.040823 0.011125 -0.006876 -0.000512 -0.009436 -0.027595 -0.014199 -0.003186 0.017385 14.444632 12.693443 -9.090228 -3.091060 16.662871 3.721208 13.977583 0.000589 97 C 12.144821 -3.611544 13.805835 -0.123217 39.613138 0.49135076E+03 0.11878413E+05 10.058115 7.358961 0.071836 1.985512 0.999578 30.078544 86.915431 0.613009 0.413307 -1.069083 0.010635 -0.017101 0.019161 0.027797 -0.017154 -0.016673 0.009064 0.055228 0.038557 -0.039300 0.000094 0.039206 12.247532 8.733612 4.988084 2.393345 18.795355 -0.822525 9.213630 0.000483 98 C 11.310473 -5.931579 13.967961 0.575266 24.608699 0.27189059E+03 0.57341367E+04 7.894031 5.852745 -0.029691 2.042532 0.999703 22.618347 63.364279 0.614718 0.472450 -1.022195 -0.021763 -0.039612 -0.022870 0.050653 -0.098264 -0.045635 0.006754 0.062274 -0.074847 -0.097725 -0.028968 0.126693 10.164037 9.139530 5.766645 3.098721 12.840510 2.824153 8.512071 -0.000324 99 C 12.134568 -4.821706 14.512243 -0.019722 42.051864 0.43553151E+03 0.10164526E+05 10.474644 6.901783 -0.050529 1.984478 0.999147 27.326420 76.307389 0.639888 0.410142 -1.076594 0.022543 0.030836 0.014424 0.040831 0.000396 -0.013067 0.007772 0.004895 0.015430 -0.014205 -0.003184 0.017388 14.444481 12.693277 7.221913 6.326753 17.871376 3.023277 12.768790 0.001325 100 C 12.144821 2.618676 15.525533 -0.123189 39.612171 0.49133765E+03 0.11878006E+05 10.057959 7.358871 0.071806 1.985508 0.999578 30.077986 86.913212 0.613012 0.413308 -1.069083 0.010648 0.025140 0.005235 0.027799 -0.005863 0.023203 -0.024835 0.027920 -0.043416 -0.039306 0.000088 0.039217 12.247322 8.733431 -0.421398 -5.516340 12.321201 4.560276 15.687334 -0.000290 101 C 11.310473 3.919099 17.453679 0.575274 24.608746 0.27189083E+03 0.57341478E+04 7.894066 5.852763 -0.029734 2.042517 0.999703 22.618374 63.364555 0.614714 0.472453 -1.022193 -0.021764 -0.000008 0.045738 0.050652 0.009616 0.107913 -0.000648 0.072830 -0.043171 -0.097726 -0.028962 0.126688 10.164082 9.139589 -0.199733 -6.543458 7.148422 0.462165 14.204236 -0.000512 102 C 12.134568 3.835524 16.220360 -0.019717 42.052120 0.43553346E+03 0.10164590E+05 10.474705 6.901811 -0.050580 1.984462 0.999147 27.326497 76.307844 0.639885 0.410144 -1.076593 0.022553 -0.002930 -0.033904 0.040825 -0.011517 0.006193 -0.008273 0.004004 0.012740 -0.014200 -0.003182 0.017382 14.444572 12.693379 1.868182 -9.417826 11.426231 0.697833 19.214105 0.000590 103 C 12.144821 0.992868 9.270156 -0.123215 39.613184 0.49135125E+03 0.11878430E+05 10.058132 7.358971 0.071836 1.985512 0.999578 30.078525 86.915438 0.613007 0.413308 -1.069082 0.010632 -0.008044 -0.024391 0.027797 0.023016 -0.006518 0.015772 0.012213 -0.090505 -0.039301 0.000093 0.039208 12.247565 8.733620 -4.566737 3.123152 10.896736 -3.737754 17.112340 0.000483 104 C 11.310473 2.012480 7.179883 0.575266 24.608745 0.27189085E+03 0.57341443E+04 7.894045 5.852749 -0.029691 2.042532 0.999703 22.618364 63.364366 0.614717 0.472451 -1.022195 -0.021766 0.039606 -0.022876 0.050653 0.088651 -0.062284 -0.006101 0.061143 -0.078244 -0.097724 -0.028969 0.126694 10.164070 9.139577 -5.566952 3.444682 12.040060 -3.286324 9.312572 -0.000318 105 C 12.134568 0.986182 7.868921 -0.019722 42.052269 0.43553489E+03 0.10164633E+05 10.474735 6.901826 -0.050539 1.984474 0.999147 27.326538 76.308025 0.639884 0.410144 -1.076592 0.022542 -0.027910 0.019495 0.040831 0.011118 0.006876 0.000515 -0.009453 -0.027626 -0.014203 -0.003185 0.017387 14.444637 12.693437 -9.090230 3.090984 16.662891 -3.721118 13.977583 0.001343 106 C 5.736621 14.754844 5.494927 -0.123212 39.612988 0.49134858E+03 0.11878345E+05 10.058090 7.358944 0.071835 1.985513 0.999578 30.078453 86.915061 0.613010 0.413307 -1.069083 0.010635 0.017102 -0.019159 0.027797 0.017155 0.016676 0.009064 0.055228 0.038552 -0.039300 0.000091 0.039209 12.247501 8.733580 -4.988078 -2.393319 18.795335 -0.822532 9.213586 -0.000484 107 C 4.902273 17.074879 5.332801 0.575267 24.608659 0.27189020E+03 0.57341262E+04 7.894013 5.852734 -0.029689 2.042532 0.999703 22.618364 63.364301 0.614720 0.472449 -1.022196 -0.021764 0.039613 0.022863 0.050652 0.098264 0.045631 0.006753 0.062274 -0.074853 -0.097724 -0.028969 0.126693 10.164006 9.139504 -5.766619 -3.098719 12.840452 2.824143 8.512062 0.000324 108 C 5.726368 15.965006 4.788519 -0.019720 42.051814 0.43553104E+03 0.10164511E+05 10.474631 6.901777 -0.050531 1.984477 0.999147 27.326401 76.307277 0.639889 0.410142 -1.076595 0.022544 -0.030837 -0.014423 0.040831 -0.000395 0.013068 0.007770 0.004898 0.015430 -0.014203 -0.003186 0.017390 14.444451 12.693243 -7.221900 -6.326721 17.871363 3.023250 12.768748 -0.001339 109 C 5.736621 8.524624 3.775229 -0.123217 39.613109 0.49135052E+03 0.11878397E+05 10.058108 7.358961 0.071829 1.985509 0.999578 30.078456 86.914925 0.613009 0.413307 -1.069083 0.010634 -0.025144 -0.005229 0.027797 0.005858 -0.023193 -0.024835 0.027910 -0.043407 -0.039301 0.000097 0.039204 12.247539 8.733591 0.421421 5.516483 12.321366 4.560364 15.687661 -0.000483 110 C 4.902273 7.224201 1.847083 0.575266 24.608853 0.27189162E+03 0.57341670E+04 7.894083 5.852765 -0.029690 2.042531 0.999703 22.618408 63.364610 0.614715 0.472452 -1.022194 -0.021765 -0.000008 -0.045738 0.050653 -0.009615 -0.107916 -0.000652 0.072838 -0.043160 -0.097725 -0.028968 0.126693 10.164137 9.139636 0.199721 6.543523 7.148428 0.462144 14.204347 0.000324 111 C 5.726368 7.307776 3.080402 -0.019724 42.052481 0.43553674E+03 0.10164689E+05 10.474777 6.901844 -0.050553 1.984469 0.999147 27.326612 76.308338 0.639882 0.410144 -1.076592 0.022544 0.002928 0.033918 0.040832 0.011512 -0.006188 -0.008284 0.004003 0.012753 -0.014202 -0.003182 0.017384 14.444720 12.693516 -1.868185 9.417971 11.426285 0.697835 19.214359 -0.001338 112 C 5.736621 10.150432 10.030606 -0.123195 39.612703 0.49134469E+03 0.11878236E+05 10.058072 7.358938 0.071808 1.985507 0.999578 30.078289 86.914734 0.613006 0.413309 -1.069080 0.010650 0.008038 0.024389 0.027801 -0.023023 0.006520 0.015775 0.012218 -0.090507 -0.039305 0.000090 0.039215 12.247459 8.733536 4.566663 -3.123086 10.896610 -3.737666 17.112231 -0.000288 113 C 4.902273 9.130820 12.120879 0.575280 24.608612 0.27188951E+03 0.57341111E+04 7.894028 5.852745 -0.029733 2.042519 0.999703 22.618293 63.364208 0.614716 0.472452 -1.022194 -0.021764 -0.039619 0.022856 0.050654 -0.088652 0.062282 -0.006094 0.061142 -0.078225 -0.097729 -0.028960 0.126689 10.164020 9.139528 5.566869 -3.444696 12.039917 -3.286326 9.312614 -0.000516 114 C 5.726368 10.157118 11.431841 -0.019724 42.052341 0.43553621E+03 0.10164675E+05 10.474751 6.901841 -0.050569 1.984464 0.999147 27.326589 76.308284 0.639882 0.410144 -1.076591 0.022553 0.027898 -0.019488 0.040826 -0.011121 -0.006880 0.000510 -0.009443 -0.027595 -0.014204 -0.003179 0.017383 14.444626 12.693417 9.090188 -3.090975 16.662831 -3.721103 13.977630 0.000577 115 C 7.079779 7.531756 5.494927 -0.123215 39.613157 0.49135136E+03 0.11878433E+05 10.058127 7.358972 0.071835 1.985512 0.999578 30.078513 86.915387 0.613007 0.413308 -1.069082 -0.010633 -0.017102 -0.019162 0.027797 0.017153 -0.016674 -0.009064 0.055232 0.038551 -0.039301 0.000093 0.039208 12.247558 8.733618 -4.988095 2.393335 18.795415 0.822549 9.213642 0.000484 116 C 7.914127 5.211721 5.332801 0.575266 24.608785 0.27189115E+03 0.57341510E+04 7.894051 5.852751 -0.029692 2.042531 0.999703 22.618358 63.364304 0.614718 0.472450 -1.022195 0.021766 -0.039614 0.022862 0.050653 0.098265 -0.045632 -0.006753 0.062273 -0.074856 -0.097724 -0.028969 0.126694 10.164084 9.139584 -5.766670 3.098786 12.840513 -2.824210 8.512156 -0.000318 117 C 7.090032 6.321594 4.788519 -0.019723 42.052248 0.43553469E+03 0.10164627E+05 10.474730 6.901823 -0.050541 1.984474 0.999147 27.326535 76.307996 0.639884 0.410144 -1.076592 -0.022543 0.030838 -0.014423 0.040831 -0.000396 -0.013066 -0.007770 0.004897 0.015426 -0.014203 -0.003185 0.017387 14.444635 12.693438 -7.221997 6.326881 17.871491 -3.023362 12.768975 0.001343 118 C 7.079779 13.761975 3.775229 -0.123217 39.613195 0.49135189E+03 0.11878447E+05 10.058116 7.358964 0.071838 1.985512 0.999578 30.078599 86.915586 0.613009 0.413306 -1.069083 -0.010637 0.025143 -0.005229 0.027797 0.005862 0.023193 0.024837 0.027903 -0.043405 -0.039300 0.000095 0.039205 12.247521 8.733596 0.421342 -5.516453 12.321410 -4.560277 15.687558 0.000483 119 C 7.914127 15.062399 1.847083 0.575269 24.608758 0.27189170E+03 0.57341635E+04 7.894031 5.852751 -0.029687 2.042532 0.999703 22.618354 63.364230 0.614719 0.472450 -1.022196 0.021763 -0.000000 -0.045740 0.050653 -0.009611 0.107918 0.000656 0.072835 -0.043162 -0.097728 -0.028965 0.126693 10.164017 9.139509 0.199749 -6.543390 7.148401 -0.462189 14.204142 -0.000324 120 C 7.090032 14.978824 3.080402 -0.019724 42.051930 0.43553331E+03 0.10164575E+05 10.474632 6.901785 -0.050519 1.984479 0.999147 27.326500 76.307547 0.639890 0.410141 -1.076596 -0.022545 -0.002927 0.033918 0.040832 0.011514 0.006187 0.008286 0.004001 0.012763 -0.014206 -0.003180 0.017386 14.444428 12.693219 -1.868183 -9.417659 11.426223 -0.697849 19.213843 0.001325 121 C 7.079779 12.136168 10.030606 -0.123189 39.612121 0.49133644E+03 0.11877971E+05 10.057958 7.358865 0.071805 1.985508 0.999578 30.077945 86.913108 0.613012 0.413308 -1.069083 -0.010646 -0.008036 0.024390 0.027799 -0.023026 -0.006523 -0.015771 0.012226 -0.090512 -0.039306 0.000087 0.039218 12.247332 8.733447 4.566613 3.123125 10.896510 3.737733 17.112038 -0.000290 122 C 7.914127 13.155780 12.120879 0.575271 24.608650 0.27188947E+03 0.57341156E+04 7.894059 5.852755 -0.029737 2.042517 0.999703 22.618375 63.364667 0.614713 0.472454 -1.022192 0.021764 0.039614 0.022862 0.050652 -0.088646 -0.062284 0.006100 0.061147 -0.078223 -0.097723 -0.028965 0.126688 10.164086 9.139602 5.566949 3.444712 12.040042 3.286349 9.312614 -0.000512 123 C 7.090032 12.129482 11.431841 -0.019714 42.052095 0.43553222E+03 0.10164558E+05 10.474727 6.901816 -0.050589 1.984460 0.999147 27.326424 76.307736 0.639882 0.410145 -1.076591 -0.022552 -0.027896 -0.019489 0.040823 -0.011125 0.006876 -0.000512 -0.009436 -0.027595 -0.014199 -0.003186 0.017385 14.444633 12.693443 9.090228 3.091060 16.662872 3.721208 13.977583 0.000590 124 C 0.671579 3.611544 13.805835 -0.123191 39.612452 0.49134164E+03 0.11878141E+05 10.058026 7.358912 0.071814 1.985510 0.999578 30.078161 86.914202 0.613008 0.413309 -1.069081 -0.010650 0.017102 0.019155 0.027800 -0.017159 0.016681 -0.009063 0.055239 0.038548 -0.039305 0.000087 0.039218 12.247399 8.733489 4.987978 -2.393282 18.795160 0.822604 9.213548 -0.000288 125 C 1.505927 5.931579 13.967961 0.575279 24.608573 0.27188913E+03 0.57341004E+04 7.894015 5.852737 -0.029734 2.042518 0.999703 22.618291 63.364173 0.614717 0.472452 -1.022194 0.021763 0.039604 -0.022884 0.050654 -0.098264 0.045634 -0.006747 0.062270 -0.074843 -0.097728 -0.028961 0.126689 10.163996 9.139499 5.766611 -3.098685 12.840461 -2.824107 8.512028 -0.000516 126 C 0.681832 4.821706 14.512243 -0.019719 42.052059 0.43553341E+03 0.10164588E+05 10.474692 6.901810 -0.050563 1.984467 0.999147 27.326490 76.307818 0.639885 0.410144 -1.076593 -0.022553 -0.030826 0.014416 0.040825 0.000396 0.013072 -0.007764 0.004889 0.015398 -0.014204 -0.003181 0.017384 14.444532 12.693325 7.221914 -6.326785 17.871410 -3.023259 12.768862 0.000578 127 C 0.671579 -2.618675 15.525533 -0.123216 39.613249 0.49135187E+03 0.11878451E+05 10.058147 7.358978 0.071827 1.985509 0.999578 30.078578 86.915674 0.613007 0.413308 -1.069081 -0.010634 -0.025145 0.005230 0.027798 -0.005863 -0.023192 0.024836 0.027909 -0.043404 -0.039300 0.000093 0.039206 12.247583 8.733646 -0.421354 5.516514 12.321432 -4.560299 15.687672 -0.000483 128 C 1.505927 -3.919099 17.453679 0.575266 24.608726 0.27189076E+03 0.57341420E+04 7.894040 5.852748 -0.029687 2.042533 0.999703 22.618358 63.364345 0.614718 0.472451 -1.022195 0.021764 -0.000008 0.045738 0.050652 0.009615 -0.107916 0.000653 0.072838 -0.043158 -0.097725 -0.028968 0.126693 10.164057 9.139553 -0.199727 6.543445 7.148401 -0.462159 14.204217 0.000324 129 C 0.681832 -3.835524 16.220360 -0.019724 42.052072 0.43553338E+03 0.10164584E+05 10.474690 6.901806 -0.050533 1.984476 0.999147 27.326481 76.307701 0.639886 0.410143 -1.076593 -0.022543 0.002928 -0.033918 0.040831 -0.011514 -0.006190 0.008285 0.004004 0.012750 -0.014203 -0.003184 0.017387 14.444555 12.693348 1.868196 9.417796 11.426260 -0.697831 19.214058 -0.001340 130 C 0.671579 -0.992868 9.270156 -0.123217 39.613076 0.49135024E+03 0.11878386E+05 10.058093 7.358953 0.071830 1.985509 0.999578 30.078457 86.914835 0.613010 0.413306 -1.069084 -0.010635 0.008043 -0.024391 0.027797 0.023015 0.006523 -0.015773 0.012212 -0.090498 -0.039301 0.000097 0.039204 12.247510 8.733570 -4.566685 -3.123192 10.896664 3.737814 17.112295 -0.000485 131 C 1.505927 -2.012480 7.179883 0.575268 24.608820 0.27189143E+03 0.57341613E+04 7.894067 5.852757 -0.029690 2.042531 0.999703 22.618415 63.364593 0.614717 0.472451 -1.022195 0.021764 -0.039607 -0.022875 0.050652 0.088650 0.062284 0.006099 0.061144 -0.078242 -0.097725 -0.028967 0.126692 10.164107 9.139613 -5.566972 -3.444718 12.040086 3.286361 9.312622 0.000324 132 C 0.681832 -0.986182 7.868921 -0.019724 42.052506 0.43553743E+03 0.10164708E+05 10.474776 6.901846 -0.050556 1.984468 0.999147 27.326630 76.308367 0.639883 0.410144 -1.076592 -0.022545 0.027910 0.019495 0.040832 0.011116 -0.006876 -0.000515 -0.009456 -0.027620 -0.014202 -0.003183 0.017385 14.444707 12.693501 -9.090272 -3.091091 16.662954 3.721247 13.977665 -0.001337 133 C 0.000000 12.361263 5.730396 0.081405 42.073351 0.42508682E+03 0.99092640E+04 10.607101 6.919677 -0.291413 1.906696 0.998766 27.168901 77.049024 0.622038 0.422401 -1.063464 0.000000 -0.002336 0.001349 0.002698 0.005800 0.010046 -0.020689 0.006849 -0.054628 -0.033103 0.015478 0.017625 13.864821 5.396953 0.098974 0.171420 20.884367 -4.824809 15.313143 0.000022 134 C 0.000000 13.636613 4.994072 0.064107 42.439903 0.42183574E+03 0.98037006E+04 10.627412 6.872261 -0.225915 1.930263 0.998846 27.033806 76.271849 0.627729 0.419843 -1.066266 -0.000000 -0.001111 0.000641 0.001282 -0.012243 -0.021204 -0.003454 -0.013541 0.005564 -0.028694 0.007837 0.020856 14.131903 8.177526 1.933207 3.348391 20.366651 -5.642230 13.851533 0.000007 135 C 0.000000 16.090368 3.577396 -0.094616 38.037962 0.46271161E+03 0.11005897E+05 9.740446 7.116710 0.046467 1.983053 0.999448 29.392576 83.910423 0.627352 0.410468 -1.072237 -0.000000 -0.020304 0.011723 0.023446 -0.014829 -0.025686 -0.008292 0.018836 -0.037997 -0.034840 0.001701 0.033139 12.094688 11.190709 3.922043 6.793141 11.309035 2.143704 13.784319 -0.000000 136 C 0.000000 9.925337 5.730396 0.081409 42.073466 0.42508685E+03 0.99092735E+04 10.607152 6.919697 -0.291429 1.906692 0.998766 27.168911 77.049298 0.622034 0.422404 -1.063461 0.000000 0.002336 0.001348 0.002697 0.005802 -0.010050 0.020688 0.006850 -0.054628 -0.033104 0.015481 0.017624 13.864904 5.396975 0.098976 -0.171420 20.884470 4.824806 15.313266 -0.000010 137 C 0.000000 8.649987 4.994072 0.064101 42.439975 0.42183605E+03 0.98037092E+04 10.627422 6.872260 -0.225896 1.930269 0.998846 27.033818 76.271880 0.627730 0.419843 -1.066267 0.000000 0.001110 0.000641 0.001282 -0.012241 0.021204 0.003456 -0.013540 0.005558 -0.028692 0.007839 0.020853 14.131938 8.177515 1.933173 -3.348385 20.366702 5.642318 13.851596 0.000000 138 C 0.000000 6.196232 3.577396 -0.094624 38.038886 0.46272381E+03 0.11006272E+05 9.740649 7.116841 0.046442 1.983043 0.999448 29.392924 83.912043 0.627341 0.410472 -1.072233 -0.000001 0.020304 0.011722 0.023445 -0.014826 0.025682 0.008296 0.018831 -0.037984 -0.034836 0.001705 0.033131 12.094990 11.191034 3.922143 -6.793403 11.309195 -2.143819 13.784741 -0.000001 139 C 0.000000 11.143300 7.839970 0.081404 42.073622 0.42508929E+03 0.99093417E+04 10.607164 6.919707 -0.291409 1.906696 0.998766 27.168995 77.049514 0.622035 0.422403 -1.063462 -0.000003 0.000000 -0.002697 0.002697 -0.011602 -0.000000 -0.000000 0.042681 0.052883 -0.033104 0.015477 0.017628 13.864909 5.396979 -0.197935 0.000003 12.527673 0.000004 23.670077 0.000241 140 C 0.000000 11.143300 9.312618 0.064099 42.439854 0.42183529E+03 0.98036869E+04 10.627408 6.872259 -0.225905 1.930268 0.998846 27.033766 76.271709 0.627729 0.419843 -1.066266 -0.000001 -0.000001 -0.001280 0.001280 0.024486 0.000002 -0.000000 -0.007553 0.023512 -0.028694 0.007837 0.020857 14.131900 8.177493 -3.866352 -0.000017 10.593944 0.000040 23.624263 0.001170 141 C 0.000000 11.143300 12.145970 -0.094652 38.039876 0.46273766E+03 0.11006692E+05 9.740823 7.116952 0.046363 1.983013 0.999448 29.393407 83.913967 0.627335 0.410473 -1.072232 0.000001 0.000001 -0.023439 0.023439 0.029659 0.000000 0.000004 0.033168 0.005131 -0.034836 0.001710 0.033126 12.095214 11.191247 -7.844491 -0.000035 15.022718 0.000045 10.071676 -0.002157 142 C 6.408200 -1.217963 13.570366 0.081410 42.073214 0.42508514E+03 0.99092164E+04 10.607088 6.919670 -0.291420 1.906694 0.998766 27.168832 77.048829 0.622037 0.422402 -1.063463 -0.000000 0.002336 -0.001348 0.002697 -0.005800 -0.010046 -0.020688 0.006853 -0.054630 -0.033103 0.015480 0.017622 13.864809 5.396949 -0.098965 -0.171429 20.884334 -4.824832 15.313144 0.000022 143 C 6.408200 -2.493313 14.306690 0.064101 42.440002 0.42183667E+03 0.98037274E+04 10.627426 6.872266 -0.225908 1.930265 0.998846 27.033844 76.271974 0.627729 0.419843 -1.066266 0.000000 0.001110 -0.000641 0.001282 0.012242 0.021204 -0.003456 -0.013544 0.005562 -0.028694 0.007840 0.020854 14.131933 8.177547 -1.933198 -3.348418 20.366665 -5.642245 13.851585 0.000008 144 C 6.408200 -4.947068 15.723366 -0.094619 38.038124 0.46271343E+03 0.11005955E+05 9.740495 7.116741 0.046460 1.983051 0.999448 29.392597 83.910624 0.627349 0.410470 -1.072236 0.000001 0.020304 -0.011723 0.023445 0.014831 0.025686 -0.008294 0.018840 -0.037991 -0.034841 0.001700 0.033140 12.094770 11.190803 -3.922079 -6.793219 11.309073 2.143751 13.784433 -0.000002 145 C 6.408200 1.217963 13.570366 0.081400 42.073711 0.42509034E+03 0.99093718E+04 10.607168 6.919710 -0.291403 1.906697 0.998766 27.169055 77.049687 0.622036 0.422402 -1.063463 0.000002 -0.002336 -0.001349 0.002698 -0.005801 0.010048 0.020691 0.006840 -0.054627 -0.033105 0.015474 0.017630 13.864910 5.396979 -0.098972 0.171413 20.884463 4.824773 15.313288 0.000241 146 C 6.408200 2.493313 14.306690 0.064104 42.439755 0.42183445E+03 0.98036626E+04 10.627395 6.872255 -0.225912 1.930267 0.998846 27.033723 76.271574 0.627729 0.419844 -1.066266 0.000001 -0.001109 -0.000641 0.001280 0.012242 -0.021207 0.003454 -0.013535 0.005559 -0.028694 0.007835 0.020859 14.131875 8.177473 -1.933157 3.348350 20.366628 5.642306 13.851525 0.001171 147 C 6.408200 4.947068 15.723366 -0.094651 38.039686 0.46273552E+03 0.11006621E+05 9.740766 7.116920 0.046371 1.983015 0.999448 29.393362 83.913581 0.627339 0.410471 -1.072234 -0.000002 -0.020299 -0.011719 0.023439 0.014830 -0.025686 0.008293 0.018805 -0.037949 -0.034836 0.001711 0.033125 12.095126 11.191160 -3.922198 6.793472 11.309344 -2.143837 13.784875 -0.002155 148 C 6.408200 0.000000 11.460792 0.081409 42.073524 0.42508759E+03 0.99092944E+04 10.607162 6.919703 -0.291429 1.906691 0.998766 27.168924 77.049340 0.622034 0.422404 -1.063461 0.000000 -0.000000 0.002697 0.002697 0.011604 0.000000 -0.000000 0.042683 0.052871 -0.033104 0.015480 0.017624 13.864918 5.396980 0.197941 -0.000011 12.527658 -0.000018 23.670116 -0.000010 149 C 6.408200 0.000000 9.988144 0.064102 42.439965 0.42183586E+03 0.98037034E+04 10.627419 6.872258 -0.225897 1.930269 0.998846 27.033819 76.271874 0.627730 0.419843 -1.066267 0.000000 -0.000000 0.001282 0.001282 -0.024484 -0.000001 0.000000 -0.007554 0.023517 -0.028693 0.007839 0.020854 14.131931 8.177512 3.866370 0.000005 10.593974 0.000025 23.624307 -0.000000 150 C 6.408200 0.000000 7.154792 -0.094623 38.038894 0.46272386E+03 0.11006277E+05 9.740652 7.116839 0.046442 1.983043 0.999448 29.392941 83.912188 0.627341 0.410472 -1.072233 0.000001 -0.000001 0.023445 0.023445 -0.029654 -0.000001 0.000001 0.033197 0.005115 -0.034836 0.001705 0.033130 12.094989 11.191021 7.844314 0.000036 15.022420 0.000046 10.071526 -0.000000 151 C 0.000000 -1.217963 13.570366 0.081409 42.073213 0.42508512E+03 0.99092159E+04 10.607088 6.919670 -0.291420 1.906695 0.998766 27.168832 77.048826 0.622038 0.422402 -1.063463 0.000000 0.002336 -0.001348 0.002697 0.005800 0.010046 -0.020688 0.006853 -0.054630 -0.033103 0.015481 0.017622 13.864808 5.396948 0.098965 0.171429 20.884333 -4.824832 15.313143 0.000022 152 C 0.000000 -2.493313 14.306690 0.064101 42.440004 0.42183669E+03 0.98037282E+04 10.627426 6.872266 -0.225908 1.930265 0.998846 27.033845 76.271977 0.627729 0.419843 -1.066266 -0.000000 0.001110 -0.000641 0.001282 -0.012242 -0.021204 -0.003456 -0.013544 0.005562 -0.028694 0.007840 0.020854 14.131933 8.177547 1.933199 3.348418 20.366666 -5.642245 13.851586 0.000008 153 C 0.000000 -4.947068 15.723366 -0.094619 38.038122 0.46271341E+03 0.11005954E+05 9.740495 7.116740 0.046460 1.983051 0.999448 29.392597 83.910623 0.627349 0.410470 -1.072236 -0.000001 0.020304 -0.011723 0.023445 -0.014831 -0.025686 -0.008294 0.018840 -0.037991 -0.034841 0.001700 0.033140 12.094769 11.190802 3.922078 6.793218 11.309073 2.143750 13.784431 -0.000002 154 C 0.000000 1.217963 13.570366 0.081400 42.073706 0.42509029E+03 0.99093702E+04 10.607168 6.919709 -0.291402 1.906697 0.998766 27.169053 77.049682 0.622036 0.422402 -1.063463 -0.000002 -0.002336 -0.001349 0.002698 0.005801 -0.010048 0.020691 0.006840 -0.054627 -0.033105 0.015474 0.017630 13.864910 5.396979 0.098972 -0.171413 20.884462 4.824773 15.313287 0.000241 155 C 0.000000 2.493313 14.306690 0.064103 42.439753 0.42183442E+03 0.98036618E+04 10.627395 6.872255 -0.225912 1.930267 0.998846 27.033722 76.271571 0.627729 0.419844 -1.066266 -0.000001 -0.001109 -0.000641 0.001280 -0.012242 0.021207 0.003454 -0.013535 0.005559 -0.028694 0.007835 0.020859 14.131875 8.177473 1.933158 -3.348350 20.366628 5.642306 13.851525 0.001171 156 C 0.000000 4.947068 15.723366 -0.094651 38.039692 0.46273561E+03 0.11006624E+05 9.740768 7.116921 0.046370 1.983015 0.999448 29.393365 83.913594 0.627339 0.410471 -1.072234 0.000002 -0.020299 -0.011719 0.023439 -0.014830 0.025686 0.008293 0.018806 -0.037949 -0.034836 0.001711 0.033125 12.095128 11.191162 3.922199 -6.793473 11.309346 -2.143837 13.784877 -0.002156 157 C 0.000000 0.000000 11.460792 0.081409 42.073522 0.42508755E+03 0.99092935E+04 10.607162 6.919702 -0.291429 1.906691 0.998766 27.168923 77.049336 0.622034 0.422404 -1.063461 -0.000000 -0.000000 0.002697 0.002697 -0.011604 -0.000000 -0.000000 0.042683 0.052871 -0.033104 0.015480 0.017624 13.864917 5.396980 -0.197941 0.000011 12.527657 -0.000018 23.670115 -0.000010 158 C 0.000000 0.000000 9.988144 0.064102 42.439963 0.42183583E+03 0.98037027E+04 10.627419 6.872258 -0.225897 1.930269 0.998846 27.033818 76.271871 0.627730 0.419843 -1.066267 -0.000000 -0.000000 0.001282 0.001282 0.024484 0.000001 0.000000 -0.007554 0.023517 -0.028693 0.007839 0.020854 14.131930 8.177512 -3.866370 -0.000005 10.593973 0.000024 23.624306 -0.000000 159 C 0.000000 0.000000 7.154792 -0.094624 38.038898 0.46272391E+03 0.11006278E+05 9.740653 7.116840 0.046441 1.983043 0.999448 29.392943 83.912198 0.627341 0.410472 -1.072233 -0.000001 -0.000001 0.023445 0.023445 0.029654 0.000001 0.000001 0.033197 0.005115 -0.034836 0.001705 0.033130 12.094990 11.191022 -7.844314 -0.000036 15.022421 0.000046 10.071527 -0.000000 160 C 6.408200 12.361263 5.730396 0.081405 42.073351 0.42508681E+03 0.99092638E+04 10.607101 6.919677 -0.291413 1.906696 0.998766 27.168901 77.049026 0.622038 0.422401 -1.063463 -0.000000 -0.002336 0.001349 0.002698 -0.005800 -0.010046 -0.020689 0.006849 -0.054628 -0.033103 0.015478 0.017625 13.864821 5.396953 -0.098974 -0.171420 20.884367 -4.824810 15.313143 0.000022 161 C 6.408200 13.636613 4.994072 0.064107 42.439901 0.42183571E+03 0.98036997E+04 10.627411 6.872261 -0.225915 1.930263 0.998846 27.033805 76.271844 0.627729 0.419843 -1.066266 0.000000 -0.001111 0.000641 0.001282 0.012243 0.021204 -0.003454 -0.013541 0.005564 -0.028694 0.007837 0.020856 14.131903 8.177525 -1.933207 -3.348391 20.366651 -5.642230 13.851532 0.000007 162 C 6.408200 16.090368 3.577396 -0.094617 38.037970 0.46271171E+03 0.11005900E+05 9.740447 7.116712 0.046467 1.983053 0.999448 29.392579 83.910438 0.627352 0.410468 -1.072237 0.000000 -0.020304 0.011723 0.023446 0.014829 0.025686 -0.008292 0.018836 -0.037997 -0.034840 0.001701 0.033139 12.094690 11.190712 -3.922044 -6.793143 11.309037 2.143704 13.784322 -0.000000 163 C 6.408200 9.925337 5.730396 0.081409 42.073465 0.42508685E+03 0.99092733E+04 10.607152 6.919697 -0.291429 1.906691 0.998766 27.168911 77.049300 0.622034 0.422404 -1.063461 -0.000000 0.002336 0.001348 0.002697 -0.005802 0.010050 0.020688 0.006850 -0.054628 -0.033104 0.015481 0.017624 13.864904 5.396975 -0.098976 0.171420 20.884471 4.824806 15.313266 -0.000010 164 C 6.408200 8.649987 4.994072 0.064101 42.439971 0.42183600E+03 0.98037079E+04 10.627422 6.872260 -0.225896 1.930269 0.998846 27.033816 76.271876 0.627729 0.419843 -1.066266 -0.000000 0.001110 0.000641 0.001282 0.012241 -0.021204 0.003456 -0.013540 0.005558 -0.028692 0.007839 0.020853 14.131938 8.177515 -1.933173 3.348384 20.366703 5.642318 13.851596 0.000000 165 C 6.408200 6.196232 3.577396 -0.094625 38.038885 0.46272378E+03 0.11006271E+05 9.740649 7.116841 0.046442 1.983043 0.999448 29.392924 83.912043 0.627341 0.410472 -1.072233 0.000001 0.020304 0.011722 0.023445 0.014826 -0.025682 0.008296 0.018831 -0.037984 -0.034836 0.001705 0.033131 12.094989 11.191033 -3.922142 6.793403 11.309195 -2.143818 13.784741 -0.000001 166 C 6.408200 11.143300 7.839970 0.081404 42.073621 0.42508928E+03 0.99093414E+04 10.607163 6.919707 -0.291409 1.906696 0.998766 27.168995 77.049513 0.622035 0.422403 -1.063462 0.000003 0.000000 -0.002697 0.002697 0.011602 0.000001 -0.000000 0.042681 0.052883 -0.033104 0.015477 0.017628 13.864909 5.396979 0.197935 -0.000003 12.527672 0.000004 23.670075 0.000241 167 C 6.408200 11.143300 9.312618 0.064099 42.439852 0.42183526E+03 0.98036860E+04 10.627407 6.872258 -0.225905 1.930268 0.998846 27.033765 76.271703 0.627729 0.419843 -1.066266 0.000001 -0.000001 -0.001280 0.001280 -0.024486 -0.000002 -0.000000 -0.007553 0.023512 -0.028694 0.007837 0.020857 14.131899 8.177492 3.866352 0.000017 10.593944 0.000040 23.624261 0.001171 168 C 6.408200 11.143300 12.145970 -0.094653 38.039880 0.46273772E+03 0.11006694E+05 9.740824 7.116952 0.046363 1.983013 0.999448 29.393409 83.913974 0.627335 0.410473 -1.072232 -0.000001 0.000001 -0.023439 0.023439 -0.029659 -0.000000 0.000004 0.033168 0.005131 -0.034836 0.001710 0.033126 12.095215 11.191249 7.844492 0.000035 15.022720 0.000045 10.071677 -0.002157 169 C 0.000000 11.143300 5.041359 -0.178979 41.666574 0.51978198E+03 0.12745289E+05 10.361352 7.546471 0.044881 1.970218 0.999789 31.025985 90.328288 0.607967 0.410864 -1.070534 0.000004 -0.000001 0.016954 0.016954 0.001142 -0.000004 0.000001 0.055308 0.062896 -0.038160 0.017195 0.020965 12.416173 5.299942 -0.378447 0.000001 20.924744 -0.000043 11.023834 0.000029 170 C 0.000000 9.937595 7.129701 -0.178982 41.667343 0.51979191E+03 0.12745622E+05 10.361557 7.546597 0.044843 1.970205 0.999789 31.026280 90.330134 0.607954 0.410870 -1.070528 -0.000003 0.014683 -0.008479 0.016955 -0.000572 -0.000992 -0.025591 0.010966 -0.070072 -0.038155 0.017185 0.020970 12.416438 5.300034 0.189237 0.327758 13.499369 4.287307 18.449912 0.000039 171 C 0.000000 12.349005 7.129701 -0.178982 41.666696 0.51978395E+03 0.12745350E+05 10.361367 7.546482 0.044880 1.970216 0.999789 31.026064 90.328558 0.607967 0.410863 -1.070535 -0.000003 -0.014683 -0.008478 0.016955 -0.000574 0.000987 0.025593 0.010978 -0.070085 -0.038161 0.017194 0.020967 12.416183 5.299949 0.189231 -0.327748 13.499120 -4.287238 18.449481 0.000112 172 C 6.408200 0.000000 14.259403 -0.178982 41.666715 0.51978416E+03 0.12745358E+05 10.361373 7.546486 0.044878 1.970216 0.999789 31.026076 90.328642 0.607966 0.410864 -1.070534 0.000002 -0.000002 -0.016955 0.016955 -0.001142 0.000003 -0.000002 0.055307 0.062902 -0.038161 0.017193 0.020967 12.416194 5.299951 0.378453 -0.000007 20.924759 -0.000084 11.023871 0.000113 173 C 6.408200 1.205705 12.171061 -0.178984 41.667509 0.51979429E+03 0.12745697E+05 10.361583 7.546615 0.044841 1.970203 0.999789 31.026372 90.330495 0.607953 0.410870 -1.070528 0.000003 -0.014685 0.008476 0.016956 0.000573 0.000991 -0.025593 0.010965 -0.070060 -0.038155 0.017183 0.020972 12.416467 5.300046 -0.189231 -0.327767 13.499374 4.287288 18.449982 0.000038 174 C 6.408200 -1.205705 12.171061 -0.178977 41.666398 0.51977952E+03 0.12745211E+05 10.361321 7.546452 0.044884 1.970221 0.999789 31.025885 90.327862 0.607968 0.410864 -1.070535 -0.000002 0.014682 0.008477 0.016954 0.000574 -0.000988 0.025592 0.010985 -0.070086 -0.038161 0.017197 0.020964 12.416137 5.299930 -0.189225 0.327739 13.499053 -4.287249 18.449427 0.000029 175 C 0.000000 0.000000 14.259403 -0.178982 41.666718 0.51978421E+03 0.12745359E+05 10.361374 7.546486 0.044878 1.970216 0.999789 31.026077 90.328647 0.607966 0.410864 -1.070534 -0.000002 -0.000002 -0.016955 0.016955 0.001142 -0.000003 -0.000002 0.055307 0.062902 -0.038161 0.017193 0.020967 12.416195 5.299951 -0.378453 0.000007 20.924762 -0.000084 11.023871 0.000113 176 C 0.000000 1.205705 12.171061 -0.178985 41.667514 0.51979436E+03 0.12745699E+05 10.361585 7.546616 0.044840 1.970203 0.999789 31.026374 90.330503 0.607953 0.410870 -1.070528 -0.000003 -0.014685 0.008476 0.016956 -0.000573 -0.000991 -0.025593 0.010965 -0.070060 -0.038155 0.017183 0.020972 12.416469 5.300046 0.189231 0.327767 13.499375 4.287289 18.449984 0.000039 177 C 0.000000 -1.205705 12.171061 -0.178977 41.666403 0.51977958E+03 0.12745213E+05 10.361322 7.546452 0.044884 1.970220 0.999789 31.025887 90.327870 0.607968 0.410864 -1.070535 0.000002 0.014682 0.008477 0.016954 -0.000574 0.000988 0.025592 0.010985 -0.070086 -0.038161 0.017197 0.020964 12.416137 5.299930 0.189225 -0.327739 13.499054 -4.287249 18.449428 0.000029 178 C 6.408200 11.143300 5.041359 -0.178980 41.666584 0.51978212E+03 0.12745294E+05 10.361354 7.546472 0.044880 1.970218 0.999789 31.025989 90.328307 0.607967 0.410864 -1.070534 -0.000004 -0.000001 0.016954 0.016954 -0.001142 0.000004 0.000001 0.055308 0.062896 -0.038160 0.017195 0.020965 12.416177 5.299944 0.378447 -0.000001 20.924750 -0.000043 11.023836 0.000029 179 C 6.408200 9.937595 7.129701 -0.178983 41.667350 0.51979201E+03 0.12745626E+05 10.361559 7.546599 0.044842 1.970205 0.999789 31.026283 90.330148 0.607953 0.410870 -1.070528 0.000003 0.014683 -0.008479 0.016955 0.000572 0.000992 -0.025591 0.010966 -0.070072 -0.038155 0.017185 0.020970 12.416441 5.300035 -0.189237 -0.327758 13.499371 4.287308 18.449916 0.000039 180 C 6.408200 12.349005 7.129701 -0.178982 41.666704 0.51978407E+03 0.12745353E+05 10.361369 7.546484 0.044879 1.970216 0.999789 31.026067 90.328572 0.607966 0.410863 -1.070535 0.000003 -0.014683 -0.008478 0.016955 0.000574 -0.000987 0.025593 0.010978 -0.070085 -0.038161 0.017193 0.020967 12.416185 5.299950 -0.189231 0.327748 13.499122 -4.287239 18.449484 0.000112 181 O 1.823774 18.025402 4.547260 -0.501968 29.264416 0.45028878E+03 0.10352157E+05 7.515069 6.501992 0.449862 2.193649 0.999250 26.816637 68.862612 0.756717 0.352073 -1.144915 -0.013295 -0.005275 -0.000133 0.014304 -0.003083 -0.046553 -0.030553 -0.016775 -0.136784 -0.078368 0.027629 0.050739 8.497304 8.010271 3.805348 0.771870 11.281545 0.498104 6.200095 -0.057892 182 O 1.858378 16.923330 6.556469 -0.522324 31.965517 0.48777404E+03 0.11442569E+05 8.027544 6.788937 0.391324 2.167117 0.999212 27.270081 70.781571 0.736860 0.354337 -1.142863 -0.018964 -0.003553 -0.009459 0.021488 -0.042066 0.021706 0.025652 0.057065 0.108750 -0.078394 0.029756 0.048638 9.579128 8.896215 3.535151 3.345824 9.942020 3.608809 9.899150 0.057843 183 O 1.823774 6.068641 1.416676 -0.501965 29.263804 0.45027795E+03 0.10351839E+05 7.514939 6.501894 0.449878 2.193657 0.999250 26.816490 68.861873 0.756726 0.352071 -1.144917 -0.013297 0.002521 0.004638 0.014307 -0.038776 0.025945 0.048524 0.014345 -0.043418 -0.078368 0.027625 0.050743 8.497139 8.010118 -1.234195 -3.681357 7.038982 1.951244 10.442316 -0.057893 184 O 1.858378 8.359704 1.366494 -0.522322 31.965816 0.48777762E+03 0.11442678E+05 8.027614 6.788970 0.391307 2.167111 0.999212 27.270098 70.781777 0.736857 0.354338 -1.142862 -0.018962 -0.006416 0.007808 0.021487 0.039831 0.025576 -0.048723 0.017101 -0.011135 -0.078392 0.029756 0.048636 9.579256 8.896337 1.130023 -4.734552 6.784595 -1.785895 13.056836 0.057840 185 O 1.823774 9.335857 13.336827 -0.501962 29.262851 0.45025742E+03 0.10351229E+05 7.514703 6.501676 0.449935 2.193677 0.999250 26.816171 68.860162 0.756753 0.352064 -1.144925 -0.013287 0.002763 -0.004477 0.014291 0.041882 0.020611 -0.017971 0.067257 0.115360 -0.078387 0.027640 0.050746 8.496875 8.009862 -2.570957 2.909449 7.901382 -2.449237 9.579381 0.057863 186 O 1.858378 8.146867 11.377799 -0.522343 31.966692 0.48779917E+03 0.11443320E+05 8.027792 6.789163 0.391269 2.167088 0.999212 27.270626 70.783756 0.736839 0.354342 -1.142857 -0.018970 0.010004 0.001659 0.021510 0.002234 -0.047268 0.023079 -0.027299 -0.144456 -0.078385 0.029754 0.048631 9.579428 8.896503 -4.665261 1.388657 13.035589 -1.823044 6.806192 -0.058061 187 O 8.231974 -6.882102 14.753502 -0.501970 29.263653 0.45027373E+03 0.10351711E+05 7.514886 6.501837 0.449884 2.193659 0.999250 26.816447 68.861502 0.756735 0.352068 -1.144920 -0.013291 0.005265 0.000140 0.014297 0.003091 0.046565 -0.030560 -0.016779 -0.136794 -0.078384 0.027639 0.050745 8.497089 8.010060 -3.805237 -0.771831 11.281265 0.498070 6.199942 0.057891 188 O 8.266578 -5.780030 12.744293 -0.522314 31.965583 0.48777608E+03 0.11442637E+05 8.027593 6.788984 0.391301 2.167110 0.999212 27.270024 70.781633 0.736852 0.354340 -1.142859 -0.018974 0.003554 0.009470 0.021502 0.042050 -0.021706 0.025651 0.057059 0.108720 -0.078376 0.029745 0.048631 9.579194 8.896268 -3.535169 -3.345835 9.942109 3.608845 9.899204 -0.057875 189 O 8.231974 5.074659 17.884086 -0.501965 29.263428 0.45026988E+03 0.10351600E+05 7.514846 6.501810 0.449902 2.193666 0.999250 26.816363 68.861206 0.756736 0.352068 -1.144920 -0.013293 -0.002507 -0.004635 0.014300 0.038785 -0.025949 0.048524 0.014338 -0.043394 -0.078374 0.027627 0.050747 8.497031 8.010014 1.234190 3.681301 7.038906 1.951235 10.442173 0.057898 190 O 8.266578 2.783596 17.934268 -0.522351 31.966559 0.48779467E+03 0.11443182E+05 8.027739 6.789099 0.391272 2.167090 0.999212 27.270605 70.783493 0.736848 0.354339 -1.142860 -0.018955 0.006429 -0.007825 0.021491 -0.039829 -0.025581 -0.048734 0.017113 -0.011196 -0.078403 0.029762 0.048641 9.579371 8.896458 -1.130031 4.734563 6.784702 -1.785907 13.056953 -0.057984 191 O 8.231974 1.807443 5.963935 -0.501966 29.263086 0.45026568E+03 0.10351474E+05 7.514760 6.501763 0.449892 2.193658 0.999250 26.816409 68.861116 0.756742 0.352066 -1.144922 -0.013297 -0.002756 0.004505 0.014307 -0.041861 -0.020608 -0.017966 0.067260 0.115338 -0.078365 0.027627 0.050738 8.496898 8.009888 2.570933 -2.909409 7.901411 -2.449182 9.579395 0.057927 192 O 8.266578 2.996433 7.922963 -0.522327 31.966511 0.48778901E+03 0.11443020E+05 8.027763 6.789073 0.391309 2.167110 0.999212 27.270216 70.782468 0.736847 0.354340 -1.142859 -0.018960 -0.009969 -0.001655 0.021485 -0.002236 0.047284 0.023068 -0.027330 -0.144436 -0.078393 0.029760 0.048633 9.579475 8.896545 4.665405 -1.388716 13.035713 -1.823114 6.806166 -0.057787 193 O 4.584426 6.882102 14.753502 -0.501964 29.263066 0.45026149E+03 0.10351349E+05 7.514751 6.501715 0.449930 2.193675 0.999250 26.816242 68.860508 0.756748 0.352065 -1.144924 0.013286 -0.005257 0.000152 0.014290 0.003092 -0.046577 0.030553 -0.016788 -0.136782 -0.078389 0.027642 0.050747 8.496932 8.009914 -3.805166 0.771794 11.281065 -0.498027 6.199818 0.057863 194 O 4.549822 5.780030 12.744293 -0.522344 31.966678 0.48779910E+03 0.11443318E+05 8.027788 6.789162 0.391271 2.167088 0.999212 27.270632 70.783771 0.736839 0.354342 -1.142857 0.018970 -0.003564 0.009492 0.021509 0.042054 0.021699 -0.025646 0.057097 0.108730 -0.078386 0.029755 0.048631 9.579415 8.896486 -3.535233 3.345893 9.942337 -3.608920 9.899423 -0.058060 195 O 4.584426 -5.074659 17.884086 -0.501965 29.263581 0.45027404E+03 0.10351723E+05 7.514883 6.501853 0.449872 2.193654 0.999250 26.816458 68.861613 0.756731 0.352070 -1.144919 0.013298 0.002521 -0.004638 0.014307 0.038775 0.025947 -0.048522 0.014347 -0.043410 -0.078367 0.027627 0.050740 8.497064 8.010036 1.234181 -3.681303 7.038943 -1.951227 10.442213 -0.057895 196 O 4.549822 -2.783596 17.934268 -0.522321 31.965962 0.48778047E+03 0.11442765E+05 8.027651 6.789002 0.391313 2.167115 0.999212 27.270089 70.781866 0.736853 0.354339 -1.142860 0.018962 -0.006415 -0.007807 0.021487 -0.039832 0.025575 0.048725 0.017100 -0.011139 -0.078393 0.029755 0.048638 9.579303 8.896380 -1.130014 -4.734584 6.784613 1.785875 13.056918 0.057839 197 O 4.584426 -1.807443 5.963935 -0.501965 29.264417 0.45028852E+03 0.10352150E+05 7.515075 6.501994 0.449874 2.193654 0.999250 26.816595 68.862518 0.756716 0.352074 -1.144914 0.013295 0.002755 0.004501 0.014305 -0.041856 0.020609 0.017968 0.067269 0.115351 -0.078367 0.027624 0.050742 8.497320 8.010300 2.571152 2.909607 7.901848 2.449399 9.579813 -0.057893 198 O 4.549822 -2.996433 7.922963 -0.522324 31.965366 0.48777089E+03 0.11442474E+05 8.027508 6.788903 0.391316 2.167113 0.999212 27.270076 70.781438 0.736864 0.354335 -1.142864 0.018964 0.009971 -0.001651 0.021490 -0.002235 -0.047283 -0.023071 -0.027331 -0.144433 -0.078392 0.029756 0.048635 9.579089 8.896185 4.665134 1.388595 13.035155 1.822931 6.805928 0.057845 199 O 10.992626 4.261198 4.547260 -0.501965 29.262617 0.45025681E+03 0.10351212E+05 7.514649 6.501673 0.449897 2.193660 0.999250 26.816328 68.860557 0.756753 0.352064 -1.144925 0.013297 0.005279 -0.000134 0.014307 -0.003083 0.046557 0.030551 -0.016774 -0.136757 -0.078365 0.027626 0.050739 8.496764 8.009747 3.805009 -0.771761 11.280783 -0.497978 6.199763 0.057925 200 O 10.958022 5.363270 6.556469 -0.522326 31.966447 0.48778770E+03 0.11442981E+05 8.027750 6.789063 0.391310 2.167111 0.999212 27.270196 70.782380 0.736848 0.354340 -1.142859 0.018960 0.003552 -0.009460 0.021484 -0.042067 -0.021706 -0.025654 0.057060 0.108733 -0.078393 0.029759 0.048633 9.579461 8.896532 3.535362 -3.345996 9.942408 -3.609027 9.899443 -0.057786 201 O 10.992626 16.217959 1.416676 -0.501961 29.263173 0.45026509E+03 0.10351459E+05 7.514792 6.501767 0.449897 2.193665 0.999250 26.816289 68.860847 0.756740 0.352067 -1.144921 0.013293 -0.002508 0.004632 0.014299 -0.038781 -0.025958 -0.048529 0.014343 -0.043423 -0.078383 0.027637 0.050746 8.496963 8.009939 -1.234179 3.681256 7.038860 -1.951218 10.442089 0.057888 202 O 10.958022 13.926896 1.366494 -0.522304 31.965212 0.48776968E+03 0.11442445E+05 8.027519 6.788931 0.391314 2.167116 0.999212 27.269915 70.781139 0.736856 0.354339 -1.142860 0.018978 0.006421 0.007815 0.021506 0.039822 -0.025562 0.048718 0.017105 -0.011145 -0.078374 0.029743 0.048631 9.579085 8.896164 1.129988 4.734376 6.784530 1.785836 13.056560 -0.057871 203 O 10.992626 12.950743 13.336827 -0.501974 29.264377 0.45028742E+03 0.10352114E+05 7.515050 6.501969 0.449883 2.193658 0.999250 26.816604 68.862423 0.756721 0.352072 -1.144916 0.013291 -0.002756 -0.004491 0.014297 0.041866 -0.020613 0.017974 0.067260 0.115359 -0.078376 0.027630 0.050746 8.497290 8.010275 -2.571140 -2.909603 7.901805 2.449385 9.579791 0.057903 204 O 10.958022 14.139733 11.377799 -0.522362 31.967002 0.48780251E+03 0.11443417E+05 8.027827 6.789164 0.391258 2.167084 0.999212 27.270736 70.784083 0.736842 0.354340 -1.142859 0.018951 -0.009990 0.001660 0.021487 0.002240 0.047285 -0.023085 -0.027313 -0.144473 -0.078406 0.029765 0.048641 9.579496 8.896577 -4.665354 -1.388685 13.035703 1.823058 6.806207 -0.057989 205 O 10.992626 -6.882102 14.753502 -0.501970 29.263653 0.45027374E+03 0.10351711E+05 7.514886 6.501837 0.449884 2.193659 0.999250 26.816447 68.861502 0.756735 0.352068 -1.144920 0.013291 0.005265 0.000140 0.014297 -0.003091 -0.046565 -0.030560 -0.016779 -0.136794 -0.078384 0.027639 0.050745 8.497089 8.010060 3.805237 0.771831 11.281266 0.498070 6.199942 0.057891 206 O 10.958022 -5.780030 12.744293 -0.522314 31.965583 0.48777607E+03 0.11442636E+05 8.027593 6.788984 0.391302 2.167110 0.999212 27.270022 70.781629 0.736852 0.354340 -1.142859 0.018974 0.003554 0.009470 0.021502 -0.042050 0.021706 0.025651 0.057059 0.108720 -0.078376 0.029745 0.048631 9.579194 8.896268 3.535169 3.345835 9.942109 3.608845 9.899205 -0.057875 207 O 10.992626 5.074659 17.884086 -0.501965 29.263427 0.45026988E+03 0.10351600E+05 7.514846 6.501810 0.449902 2.193666 0.999250 26.816363 68.861205 0.756736 0.352068 -1.144920 0.013293 -0.002507 -0.004635 0.014300 -0.038785 0.025949 0.048524 0.014338 -0.043394 -0.078374 0.027627 0.050747 8.497031 8.010013 -1.234190 -3.681301 7.038906 1.951235 10.442173 0.057898 208 O 10.958022 2.783596 17.934268 -0.522351 31.966556 0.48779463E+03 0.11443181E+05 8.027739 6.789099 0.391273 2.167090 0.999212 27.270604 70.783489 0.736848 0.354339 -1.142860 0.018955 0.006429 -0.007825 0.021491 0.039829 0.025581 -0.048734 0.017113 -0.011196 -0.078403 0.029762 0.048641 9.579370 8.896458 1.130031 -4.734563 6.784701 -1.785906 13.056952 -0.057984 209 O 10.992626 1.807443 5.963935 -0.501966 29.263090 0.45026575E+03 0.10351476E+05 7.514760 6.501764 0.449892 2.193658 0.999250 26.816409 68.861119 0.756742 0.352067 -1.144922 0.013297 -0.002756 0.004505 0.014307 0.041861 0.020608 -0.017967 0.067260 0.115338 -0.078365 0.027627 0.050738 8.496899 8.009889 -2.570933 2.909409 7.901413 -2.449183 9.579396 0.057927 210 O 10.958022 2.996433 7.922963 -0.522326 31.966505 0.48778890E+03 0.11443017E+05 8.027761 6.789072 0.391309 2.167111 0.999212 27.270214 70.782459 0.736847 0.354340 -1.142859 0.018960 -0.009969 -0.001655 0.021484 0.002236 -0.047284 0.023068 -0.027330 -0.144436 -0.078393 0.029760 0.048633 9.579473 8.896543 -4.665404 1.388716 13.035710 -1.823114 6.806165 -0.057787 211 O 4.584426 18.025402 4.547260 -0.501968 29.264411 0.45028870E+03 0.10352154E+05 7.515068 6.501991 0.449862 2.193650 0.999250 26.816635 68.862605 0.756717 0.352073 -1.144915 0.013295 -0.005275 -0.000133 0.014304 0.003083 0.046553 -0.030553 -0.016775 -0.136784 -0.078368 0.027629 0.050739 8.497303 8.010270 -3.805348 -0.771870 11.281544 0.498104 6.200094 -0.057892 212 O 4.549822 16.923330 6.556469 -0.522324 31.965511 0.48777392E+03 0.11442566E+05 8.027542 6.788936 0.391324 2.167117 0.999212 27.270079 70.781562 0.736860 0.354337 -1.142863 0.018964 -0.003553 -0.009459 0.021488 0.042066 -0.021706 0.025652 0.057065 0.108750 -0.078394 0.029756 0.048638 9.579126 8.896213 -3.535150 -3.345824 9.942018 3.608808 9.899148 0.057843 213 O 4.584426 6.068641 1.416676 -0.501965 29.263805 0.45027796E+03 0.10351839E+05 7.514939 6.501894 0.449878 2.193657 0.999250 26.816490 68.861873 0.756726 0.352071 -1.144917 0.013297 0.002521 0.004638 0.014307 0.038776 -0.025945 0.048523 0.014345 -0.043418 -0.078368 0.027625 0.050743 8.497139 8.010118 1.234195 3.681357 7.038982 1.951244 10.442317 -0.057893 214 O 4.549822 8.359704 1.366494 -0.522322 31.965803 0.48777738E+03 0.11442671E+05 8.027611 6.788968 0.391308 2.167112 0.999212 27.270094 70.781759 0.736857 0.354338 -1.142862 0.018962 -0.006416 0.007808 0.021487 -0.039831 -0.025576 -0.048723 0.017101 -0.011136 -0.078392 0.029756 0.048636 9.579252 8.896334 -1.130023 4.734549 6.784593 -1.785894 13.056830 0.057840 215 O 4.584426 9.335857 13.336827 -0.501962 29.262848 0.45025735E+03 0.10351227E+05 7.514702 6.501676 0.449936 2.193678 0.999250 26.816170 68.860157 0.756753 0.352064 -1.144925 0.013287 0.002763 -0.004477 0.014291 -0.041882 -0.020611 -0.017971 0.067257 0.115360 -0.078386 0.027640 0.050746 8.496874 8.009861 2.570956 -2.909448 7.901381 -2.449237 9.579380 0.057863 216 O 4.549822 8.146867 11.377799 -0.522343 31.966690 0.48779913E+03 0.11443319E+05 8.027792 6.789162 0.391269 2.167088 0.999212 27.270625 70.783753 0.736839 0.354342 -1.142857 0.018970 0.010004 0.001659 0.021510 -0.002234 0.047268 0.023079 -0.027299 -0.144456 -0.078384 0.029754 0.048631 9.579428 8.896503 4.665261 -1.388657 13.035589 -1.823045 6.806191 -0.058061 217 O 8.231974 4.261198 4.547260 -0.501965 29.262612 0.45025673E+03 0.10351209E+05 7.514648 6.501672 0.449898 2.193660 0.999250 26.816327 68.860551 0.756753 0.352064 -1.144925 -0.013297 0.005279 -0.000134 0.014307 0.003083 -0.046557 0.030551 -0.016774 -0.136757 -0.078365 0.027626 0.050739 8.496763 8.009746 -3.805008 0.771760 11.280781 -0.497978 6.199762 0.057926 218 O 8.266578 5.363270 6.556469 -0.522326 31.966440 0.48778759E+03 0.11442978E+05 8.027749 6.789062 0.391310 2.167111 0.999212 27.270194 70.782371 0.736848 0.354340 -1.142859 -0.018960 0.003552 -0.009460 0.021484 0.042067 0.021706 -0.025654 0.057060 0.108733 -0.078393 0.029759 0.048633 9.579459 8.896530 -3.535362 3.345995 9.942406 -3.609026 9.899442 -0.057786 219 O 8.231974 16.217959 1.416676 -0.501961 29.263170 0.45026504E+03 0.10351458E+05 7.514792 6.501767 0.449897 2.193665 0.999250 26.816288 68.860843 0.756740 0.352067 -1.144921 -0.013293 -0.002508 0.004632 0.014299 0.038781 0.025958 -0.048529 0.014343 -0.043423 -0.078383 0.027637 0.050746 8.496962 8.009938 1.234178 -3.681256 7.038860 -1.951218 10.442088 0.057888 220 O 8.266578 13.926896 1.366494 -0.522304 31.965207 0.48776958E+03 0.11442442E+05 8.027518 6.788930 0.391315 2.167116 0.999212 27.269913 70.781131 0.736856 0.354339 -1.142860 -0.018978 0.006421 0.007815 0.021506 -0.039822 0.025562 0.048718 0.017105 -0.011145 -0.078374 0.029743 0.048631 9.579083 8.896163 -1.129988 -4.734376 6.784529 1.785836 13.056558 -0.057871 221 O 8.231974 12.950743 13.336827 -0.501974 29.264369 0.45028726E+03 0.10352110E+05 7.515049 6.501968 0.449884 2.193658 0.999250 26.816601 68.862410 0.756721 0.352072 -1.144916 -0.013291 -0.002756 -0.004491 0.014297 -0.041866 0.020613 0.017974 0.067260 0.115360 -0.078376 0.027630 0.050746 8.497288 8.010273 2.571139 2.909602 7.901803 2.449384 9.579789 0.057903 222 O 8.266578 14.139733 11.377799 -0.522362 31.966995 0.48780237E+03 0.11443413E+05 8.027826 6.789162 0.391258 2.167084 0.999212 27.270734 70.784073 0.736843 0.354340 -1.142859 -0.018951 -0.009990 0.001660 0.021487 -0.002240 -0.047285 -0.023084 -0.027313 -0.144473 -0.078406 0.029765 0.048641 9.579494 8.896575 4.665353 1.388685 13.035700 1.823057 6.806206 -0.057989 223 O 1.823774 6.882102 14.753502 -0.501964 29.263066 0.45026148E+03 0.10351349E+05 7.514750 6.501715 0.449930 2.193675 0.999250 26.816243 68.860509 0.756749 0.352065 -1.144924 -0.013286 -0.005258 0.000152 0.014290 -0.003092 0.046577 0.030553 -0.016788 -0.136782 -0.078389 0.027642 0.050747 8.496932 8.009913 3.805165 -0.771794 11.281064 -0.498027 6.199817 0.057863 224 O 1.858378 5.780030 12.744293 -0.522344 31.966678 0.48779911E+03 0.11443318E+05 8.027788 6.789162 0.391271 2.167088 0.999212 27.270631 70.783770 0.736839 0.354342 -1.142857 -0.018970 -0.003564 0.009492 0.021509 -0.042054 -0.021699 -0.025646 0.057097 0.108730 -0.078386 0.029755 0.048631 9.579416 8.896487 3.535233 -3.345893 9.942338 -3.608920 9.899423 -0.058061 225 O 1.823774 -5.074659 17.884086 -0.501965 29.263571 0.45027386E+03 0.10351717E+05 7.514881 6.501851 0.449873 2.193654 0.999250 26.816454 68.861597 0.756732 0.352070 -1.144919 -0.013298 0.002521 -0.004638 0.014307 -0.038775 -0.025947 -0.048522 0.014347 -0.043410 -0.078367 0.027627 0.050740 8.497062 8.010034 -1.234181 3.681302 7.038941 -1.951226 10.442210 -0.057895 226 O 1.858378 -2.783596 17.934268 -0.522321 31.965961 0.48778045E+03 0.11442764E+05 8.027651 6.789002 0.391313 2.167115 0.999212 27.270089 70.781864 0.736853 0.354339 -1.142860 -0.018962 -0.006415 -0.007807 0.021487 0.039832 -0.025575 0.048725 0.017100 -0.011139 -0.078393 0.029755 0.048638 9.579303 8.896379 1.130014 4.734583 6.784612 1.785875 13.056917 0.057839 227 O 1.823774 -1.807443 5.963935 -0.501965 29.264415 0.45028849E+03 0.10352149E+05 7.515075 6.501993 0.449874 2.193654 0.999250 26.816595 68.862516 0.756716 0.352074 -1.144914 -0.013295 0.002755 0.004501 0.014305 0.041856 -0.020609 0.017968 0.067269 0.115351 -0.078367 0.027624 0.050742 8.497319 8.010299 -2.571152 -2.909607 7.901847 2.449399 9.579812 -0.057893 228 O 1.858378 -2.996433 7.922963 -0.522324 31.965359 0.48777077E+03 0.11442471E+05 8.027506 6.788902 0.391317 2.167114 0.999212 27.270074 70.781428 0.736864 0.354335 -1.142864 -0.018964 0.009971 -0.001651 0.021490 0.002235 0.047283 -0.023071 -0.027331 -0.144433 -0.078392 0.029757 0.048635 9.579087 8.896183 -4.665133 -1.388594 13.035152 1.822930 6.805927 0.057845 ****************************************************** Auxiliary information for the entire system The total spin magnetic moment of the unit cell is -0.000212 The total net atomic charge of the unit cell is -0.000002 Accuracy of reproducing the electrostatic potential in the unit cell: The inner radius (bohr) = 5.0000 The outer radius (bohr) = 12.0000 Valid grid points have density less than (e/(bohr^3)) = 0.0001 The number of valid grid points were= 597132 The rms potential error without charges in kcal/mol is= 3.19358 The rms potential error with partial charges in kcal/mol is= 1.47340 The RRMSE value at monopole order= 0.46136 The rms potential error with partial charges and cloud penetration in kcal/mol is= 1.49929 The RRMSE value at monopole order with cloud penetration is= 0.46947 The rms potential error with partial charges and atomic dipoles in kcal/mol is= 0.56212 The RRMSE value at dipole order= 0.17602 The rms potential error with partial charges, atomic dipoles and cloud penetration in kcal/mol is= 0.54327 The RRMSE value at dipole order with cloud penetration= 0.17011 ****************************************************** The electron densities and ab initio electrostatic potential were computed in VASP using the PBE functional and projector augmented wave method. See the main text of the journal article for a description of computational details. The atomic charges, dipoles, and quadrupoles were computed with the DDEC6 method as described in (a) T. A. Manz and N. Gabaldon Limas, RSC Adv. 6 (2016) 47771-47801 DOI: 10.1039/c6ra04656h (b) N. Gabaldon Limas and T. A. Manz, RSC Adv. 8 (2018) 2678-2707 DOI: 10.1039/c7ra11829e. For each atom in the material, the electron cloud parameters were fit to the spherically averaged atom-in-material electron density using radial positions for which this density was between 10^-4 and 10^-2 electrons per cubic bohr. The polarizabilities, dispersion coefficients, and quantum Drude oscillator (QDO) parameters were fit using the MCLF method. The magnetic structure of the system was optimized in VASP from the default ferromagnetic initial guess using spin polarization. The atomic spin moments (ASMs) were computed on this optimized magnetic structure using the DDEC6 partition as inputs to the method of T. A. Manz and D. S. Sholl, J. Chem. Theory Comput. 7 (2011) 4146-4164 DOI: 10.1021/ct200539n. The RMSE and RRMSE were computed using a uniform grid with Ewald summation.