244 jmolscript: load "" {1 1 1} spacegroup "x,y,z" unitcell [{ 8.188100 0.000000 0.000000 }, { -3.147954 16.287378 0.000000 }, { 0.000000 0.000000 26.736200 }] Nd 4.005768 12.535418 19.894406 2.080403 Nd 5.128428 3.751960 6.526306 2.080403 Nd 1.034378 3.751960 6.841794 2.080402 Nd -0.088282 12.535418 20.209894 2.080402 H -0.979291 9.430392 21.763267 0.101065 H 5.208689 7.637152 20.929097 0.110228 H 6.559999 7.902636 20.175137 0.114811 H -0.412183 6.936794 21.923684 0.091803 H 6.689651 5.905803 21.450453 0.106786 H 6.012781 7.891235 24.808520 0.106802 H -0.835911 8.184407 24.043865 0.089351 H 4.775077 8.940142 23.153549 0.112384 H 5.889747 9.938558 23.626780 0.112592 H 0.992696 16.173366 20.907708 0.090884 H 2.466117 16.222228 23.351397 0.117098 H 1.105697 15.461608 23.164244 0.107100 H 3.900538 1.306248 24.212303 0.112592 H 3.103262 1.211781 22.862125 0.089583 H 4.197167 2.465909 20.803437 0.088190 H 5.566527 3.176039 21.089515 0.109237 H 5.860314 1.122200 19.926490 0.108485 H 6.657018 1.143374 21.276668 0.112471 H 1.942263 5.244536 2.299313 0.091366 H 4.779837 5.483960 2.299313 0.111408 H 3.805929 6.697370 2.518550 0.108585 H 2.307832 2.925213 2.088097 0.113936 H 3.860000 3.159751 2.074729 0.102482 H 2.071536 4.016467 0.042778 0.091312 H 3.165439 2.902411 26.602519 0.106754 H 4.541466 6.624077 0.299445 0.104307 H 2.980360 6.461203 0.363612 0.085585 H 1.925387 6.856986 8.395167 0.101065 H 3.925507 8.650226 7.560997 0.110228 H 2.574197 8.384742 6.807037 0.114811 H 1.358279 9.350584 8.555584 0.091803 H 2.444545 10.381575 8.082353 0.106786 H 3.121415 8.396143 11.440420 0.106802 H 1.782007 8.102971 10.675765 0.089351 H 4.359119 7.347236 9.785449 0.112384 H 3.244449 6.348820 10.258680 0.112592 H -0.046600 0.114012 7.539608 0.090884 H 6.668079 0.065150 9.983297 0.117098 H -0.159601 0.825770 9.796144 0.107100 H 5.233658 14.981130 10.844203 0.112592 H -2.157166 15.075597 9.494025 0.089583 H 4.937029 13.821469 7.435337 0.088190 H 3.567669 13.111339 7.721415 0.109237 H 3.273882 15.165178 6.558390 0.108485 H 2.477178 15.144004 7.908568 0.112472 H -0.996167 11.042842 15.667413 0.091366 H 4.354359 10.803418 15.667413 0.111408 H 5.328267 9.590008 15.886650 0.108585 H -1.361736 13.362165 15.456197 0.113936 H 5.274196 13.127627 15.442829 0.102482 H -1.125440 12.270911 13.410878 0.091312 H -2.219343 13.384967 13.234419 0.106754 H 4.592730 9.663301 13.667545 0.104307 H 6.153836 9.826175 13.731712 0.085585 H 6.019437 6.856986 4.972933 0.101065 H -0.168543 8.650226 5.807103 0.110228 H -1.519853 8.384742 6.561063 0.114810 H 5.452329 9.350584 4.812516 0.091803 H -1.649505 10.381575 5.285747 0.106786 H -0.972635 8.396143 1.927680 0.106802 H 5.876057 8.102971 2.692335 0.089351 H 0.265069 7.347236 3.582651 0.112384 H -0.849601 6.348820 3.109420 0.112592 H 4.047450 0.114012 5.828492 0.090884 H 2.574029 0.065150 3.384803 0.117098 H 3.934449 0.825770 3.571956 0.107099 H 1.139608 14.981130 2.523897 0.112592 H 1.936884 15.075597 3.874075 0.089583 H 0.842979 13.821469 5.932763 0.088190 H -0.526381 13.111339 5.646685 0.109237 H -0.820168 15.165178 6.809710 0.108485 H -1.616872 15.144004 5.459532 0.112472 H 3.097883 11.042842 24.436887 0.091366 H 0.260309 10.803418 24.436887 0.111408 H 1.234217 9.590008 24.217650 0.108585 H 2.732314 13.362165 24.648103 0.113936 H 1.180146 13.127627 24.661471 0.102482 H 2.968610 12.270911 26.693422 0.091312 H 1.874707 13.384967 0.133681 0.106753 H 0.498680 9.663301 26.436755 0.104307 H 2.059786 9.826175 26.372588 0.085585 H 3.114759 9.430392 18.341033 0.101065 H 1.114639 7.637152 19.175203 0.110228 H 2.465949 7.902636 19.929163 0.114810 H 3.681867 6.936794 18.180616 0.091803 H 2.595601 5.905803 18.653847 0.106786 H 1.918731 7.891235 15.295780 0.106802 H 3.258139 8.184407 16.060435 0.089351 H 0.681027 8.940142 16.950751 0.112384 H 1.795697 9.938558 16.477520 0.112592 H -3.101354 16.173366 19.196592 0.090884 H -1.627933 16.222228 16.752903 0.117098 H -2.988353 15.461608 16.940056 0.107099 H -0.193512 1.306248 15.891997 0.112592 H 7.197312 1.211781 17.242175 0.089583 H 0.103117 2.465909 19.300863 0.088190 H 1.472477 3.176039 19.014785 0.109237 H 1.766264 1.122200 20.177810 0.108485 H 2.562968 1.143374 18.827632 0.112472 H 6.036313 5.244536 11.068787 0.091366 H 0.685787 5.483960 11.068787 0.111408 H -0.288121 6.697370 10.849550 0.108585 H 6.401882 2.925213 11.280003 0.113936 H -0.234050 3.159751 11.293371 0.102482 H 6.165586 4.016467 13.325322 0.091312 H 7.259489 2.902411 13.501781 0.106753 H 0.447416 6.624077 13.068655 0.104307 H -1.113690 6.461203 13.004488 0.085585 C 5.565966 10.270821 20.990591 0.665375 C 2.521439 14.919238 20.966528 0.671298 C 6.261553 9.192596 21.725836 -0.117862 C 6.145993 7.858660 21.052084 -0.219753 C 6.822304 6.765777 21.880906 -0.086797 C 6.412367 7.975929 23.928899 -0.086097 C 5.732342 9.096501 23.169591 -0.210436 C 5.646339 5.635433 23.733725 0.493201 C 1.871656 16.158708 21.351529 -0.119597 C 1.617453 16.236887 22.880840 -0.216516 C 3.992240 1.242727 23.249800 -0.087000 C 4.849344 3.565307 23.487752 0.480648 C 2.790814 4.607699 4.071923 0.678255 C 5.024160 2.402388 21.308751 -0.083350 C 5.767412 1.136859 20.891667 -0.220757 C 4.516997 4.687507 25.394043 0.483061 C 2.809920 4.873183 2.550633 -0.120119 C 3.908148 5.842282 2.069382 -0.227478 C 3.005382 3.544133 1.820735 -0.218924 C 2.962379 3.741211 0.310140 -0.084998 C 3.825023 6.039360 0.590870 -0.083725 C 3.568230 6.016557 7.622491 0.665375 C 6.612757 1.368140 7.598428 0.671298 C 2.872643 7.094782 8.357736 -0.117862 C 2.988203 8.428718 7.683984 -0.219753 C 2.311892 9.521601 8.512806 -0.086797 C 2.721829 8.311449 10.560799 -0.086097 C 3.401854 7.190877 9.801491 -0.210436 C 3.487857 10.651945 10.365625 0.493201 C 7.262540 0.128670 7.983429 -0.119597 C 7.516743 0.050491 9.512740 -0.216516 C 5.141956 15.044651 9.881700 -0.087000 C 4.284852 12.722071 10.119652 0.480648 C -1.844718 11.679679 17.440023 0.678255 C 4.110036 13.884990 7.940651 -0.083350 C 3.366784 15.150519 7.523567 -0.220757 C 4.617199 11.599871 12.025943 0.483061 C -1.863824 11.414195 15.918733 -0.120119 C 5.226048 10.445096 15.437482 -0.227478 C -2.059286 12.743245 15.188835 -0.218924 C -2.016283 12.546167 13.678240 -0.084998 C 5.309173 10.248018 13.958970 -0.083725 C -0.525820 6.016557 5.745609 0.665375 C 2.518707 1.368140 5.769672 0.671298 C -1.221407 7.094782 5.010364 -0.117862 C -1.105847 8.428718 5.684116 -0.219753 C -1.782158 9.521601 4.855294 -0.086797 C -1.372221 8.311449 2.807301 -0.086097 C -0.692196 7.190877 3.566609 -0.210436 C -0.606193 10.651945 3.002475 0.493201 C 3.168490 0.128670 5.384671 -0.119597 C 3.422693 0.050491 3.855360 -0.216516 C 1.047906 15.044651 3.486400 -0.087000 C 0.190802 12.722071 3.248448 0.480648 C 2.249332 11.679679 22.664277 0.678255 C 0.015986 13.884990 5.427449 -0.083350 C -0.727266 15.150519 5.844533 -0.220757 C 0.523149 11.599871 1.342157 0.483061 C 2.230226 11.414195 24.185567 -0.120119 C 1.131998 10.445096 24.666818 -0.227478 C 2.034764 12.743245 24.915465 -0.218924 C 2.077767 12.546167 26.426060 -0.084998 C 1.215123 10.248018 26.145330 -0.083725 C 1.471916 10.270821 19.113709 0.665375 C -1.572611 14.919238 19.137772 0.671298 C 2.167503 9.192596 18.378464 -0.117863 C 2.051943 7.858660 19.052216 -0.219753 C 2.728254 6.765777 18.223394 -0.086797 C 2.318317 7.975929 16.175401 -0.086097 C 1.638292 9.096501 16.934709 -0.210436 C 1.552289 5.635433 16.370575 0.493201 C -2.222394 16.158708 18.752771 -0.119597 C -2.476597 16.236887 17.223460 -0.216516 C -0.101810 1.242727 16.854500 -0.087000 C 0.755294 3.565307 16.616548 0.480648 C 6.884864 4.607699 9.296177 0.678255 C 0.930110 2.402388 18.795549 -0.083350 C 1.673362 1.136859 19.212633 -0.220757 C 0.422947 4.687507 14.710257 0.483061 C 6.903970 4.873183 10.817467 -0.120119 C -0.185902 5.842282 11.298718 -0.227478 C 7.099432 3.544133 11.547365 -0.218924 C 7.056429 3.741211 13.057960 -0.084998 C -0.269027 6.039360 12.777230 -0.083725 N 6.278800 6.726687 23.217716 -0.106168 N 5.508380 4.599556 22.923618 -0.568260 N 5.177044 5.746187 24.958243 -0.562146 N 4.716604 2.421933 22.739138 -0.116371 N 4.317430 3.542505 24.701575 -0.567732 N 3.930924 4.754286 26.645297 -0.121225 N 2.855396 9.560691 9.849616 -0.106168 N 3.625816 11.687822 9.555518 -0.568260 N 3.957152 10.541191 11.590143 -0.562146 N 4.417592 13.865445 9.371038 -0.116371 N 4.816766 12.744873 11.333475 -0.567732 N 5.203272 11.533092 13.277197 -0.121225 N -1.238654 9.560691 3.518484 -0.106168 N -0.468234 11.687822 3.812582 -0.568260 N -0.136898 10.541191 1.777957 -0.562146 N 0.323542 13.865445 3.997062 -0.116371 N 0.722716 12.744873 2.034625 -0.567732 N 1.109222 11.533092 0.090903 -0.121225 N 2.184750 6.726687 16.886584 -0.106168 N 1.414330 4.599556 17.180682 -0.568260 N 1.082994 5.746187 15.146057 -0.562146 N 0.622554 2.421933 17.365162 -0.116371 N 0.223380 3.542505 15.402725 -0.567732 N -0.163126 4.754286 13.459003 -0.121225 O 4.429632 10.083516 20.453193 -0.579097 O -2.114060 11.476087 20.974549 -0.784895 O 3.772761 14.816628 21.060105 -0.622914 O 3.891368 4.742884 4.692203 -0.708201 O 1.871476 13.935481 20.487950 -0.780542 O 1.711655 4.234718 4.566543 -0.648473 O 4.704564 6.203862 7.085093 -0.579097 O 3.060156 4.811291 7.606449 -0.784895 O 5.361435 1.470750 7.692005 -0.622914 O 5.242828 11.544494 18.060303 -0.708201 O 7.262720 2.351897 7.119850 -0.780542 O -0.765559 12.052660 17.934643 -0.648473 O 0.610514 6.203862 6.283007 -0.579097 O 7.154206 4.811291 5.761651 -0.784895 O 1.267385 1.470750 5.676095 -0.622914 O 1.148778 11.544494 22.043997 -0.708201 O 3.168670 2.351897 6.248250 -0.780542 O 3.328491 12.052660 22.169657 -0.648473 O 0.335582 10.083516 19.651107 -0.579097 O 1.979990 11.476087 19.129751 -0.784895 O -0.321289 14.816628 19.044195 -0.622914 O -0.202682 4.742884 8.675897 -0.708201 O -2.222574 13.935481 19.616350 -0.780542 O 5.805705 4.234718 8.801557 -0.648473 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 Nd 4.005768 12.535418 19.894406 2.080403 157.104060 0.37058372E+04 0.13262446E+06 19.003710 16.181324 2.664058 2.487485 0.999724 85.346461 207.559853 0.645945 0.264956 -1.337486 0.014444 -0.012675 0.008200 0.020894 0.022226 0.125232 -0.036905 0.032023 0.262310 -0.129677 -0.039647 0.169324 22.862108 29.514100 -1.003654 -6.682236 21.528386 0.604062 17.543838 0.000019 2 Nd 5.128428 3.751960 6.526306 2.080403 157.104005 0.37058357E+04 0.13262439E+06 19.003705 16.181319 2.664058 2.487485 0.999724 85.346454 207.559820 0.645946 0.264956 -1.337486 -0.014444 0.012675 0.008200 0.020894 0.022226 -0.125231 0.036905 0.032023 0.262310 -0.129677 -0.039646 0.169323 22.862101 29.514090 -1.003654 6.682234 21.528381 -0.604062 17.543833 0.000027 3 Nd 1.034378 3.751960 6.841794 2.080402 157.104286 0.37058437E+04 0.13262475E+06 19.003732 16.181341 2.664057 2.487485 0.999724 85.346482 207.559975 0.645945 0.264956 -1.337486 -0.014444 0.012675 -0.008200 0.020894 0.022226 0.125232 -0.036905 0.032023 0.262310 -0.129677 -0.039647 0.169324 22.862136 29.514137 -1.003656 -6.682246 21.528413 0.604063 17.543857 0.000024 4 Nd -0.088282 12.535418 20.209894 2.080402 157.104335 0.37058451E+04 0.13262482E+06 19.003736 16.181345 2.664057 2.487485 0.999724 85.346489 207.560006 0.645945 0.264956 -1.337486 0.014444 -0.012675 -0.008200 0.020894 0.022226 -0.125232 0.036905 0.032023 0.262310 -0.129677 -0.039647 0.169324 22.862141 29.514145 -1.003656 6.682248 21.528417 -0.604063 17.543861 0.000024 5 H -0.979291 9.430392 21.763267 0.101065 1.081183 0.85012906E+01 0.85606905E+02 1.804955 1.750063 -1.164266 2.313970 0.993120 3.874810 11.359112 0.450224 1.350995 -0.692281 0.035544 0.003545 0.000265 0.035722 0.001162 -0.000354 0.001264 0.008033 -0.012231 -0.004733 -0.001490 0.006223 1.862275 2.317294 0.266957 -0.029469 1.653548 -0.068912 1.615982 -0.000001 6 H 5.208689 7.637152 20.929097 0.110228 1.038195 0.81470726E+01 0.80001438E+02 1.667723 1.645694 -0.769589 2.499125 0.998974 3.494080 9.646319 0.500360 1.246602 -0.716672 -0.026013 -0.005877 0.001484 0.026710 0.005197 0.001656 0.002449 0.004245 -0.017581 -0.006664 -0.002388 0.009052 1.677021 2.096583 0.127727 0.190724 1.476712 -0.006551 1.457769 -0.000002 7 H 6.559999 7.902636 20.175137 0.114811 1.109380 0.84595496E+01 0.83289470E+02 1.705230 1.648225 -0.753079 2.510563 0.999124 3.373801 9.122606 0.516590 1.204251 -0.727802 0.014514 0.004431 -0.022230 0.026915 -0.003379 -0.003735 -0.001754 -0.010932 0.014811 -0.010007 0.003778 0.006229 1.737288 1.644402 0.033178 -0.381820 1.429059 -0.096752 2.138403 -0.000003 8 H -0.412183 6.936794 21.923684 0.091803 1.148777 0.88607144E+01 0.87457483E+02 1.687512 1.640190 -0.652528 2.547399 0.999841 3.336065 8.767796 0.545038 1.138547 -0.744817 0.026499 0.008674 -0.000209 0.027884 0.000135 0.000761 -0.003168 0.009968 0.007847 -0.007315 0.002973 0.004342 1.711848 2.246517 0.160077 -0.090453 1.450588 -0.021614 1.438439 -0.000003 9 H 6.689651 5.905803 21.450453 0.106786 1.191629 0.89662120E+01 0.89018951E+02 1.731443 1.648406 -1.041867 2.361082 0.997835 3.481806 9.265085 0.542853 1.136451 -0.743001 -0.007763 -0.025342 -0.018950 0.032582 -0.004957 0.000348 0.010686 -0.001909 0.045190 -0.014630 -0.004910 0.019540 1.759038 1.420927 0.138119 -0.036250 2.269173 0.247259 1.587014 -0.000000 10 H 6.012781 7.891235 24.808520 0.106802 1.170233 0.87964108E+01 0.87219299E+02 1.735068 1.651958 -1.011514 2.374684 0.998250 3.499828 9.413239 0.530977 1.163385 -0.736100 -0.016801 0.001708 0.027095 0.031926 -0.007857 -0.002383 0.012698 -0.003431 0.022830 -0.014339 -0.003823 0.018161 1.769792 1.534643 0.130956 -0.300522 1.557794 -0.169244 2.216939 -0.000002 11 H -0.835911 8.184407 24.043865 0.089351 1.115993 0.84139478E+01 0.82717533E+02 1.707464 1.636098 -0.693919 2.527607 0.999434 3.465564 9.359671 0.522226 1.193026 -0.729605 0.026667 0.007497 0.000960 0.027717 -0.002521 0.004867 0.002703 0.002140 -0.015023 -0.008457 0.002315 0.006142 1.754708 2.262447 0.360548 0.207542 1.541648 0.074262 1.460028 -0.000002 12 H 4.775077 8.940142 23.153549 0.112384 1.053667 0.83383415E+01 0.82089151E+02 1.672640 1.657444 -0.681531 2.546235 0.999604 3.386911 9.263667 0.503582 1.235462 -0.720617 -0.026524 -0.009523 -0.003339 0.028379 0.001607 -0.000032 -0.003322 0.013818 -0.005860 -0.007936 -0.000152 0.008088 1.678708 2.153225 -0.009148 -0.013121 1.441136 -0.029496 1.441765 -0.000002 13 H 5.889747 9.938558 23.626780 0.112592 1.100006 0.85772923E+01 0.84878847E+02 1.709739 1.672469 -0.655604 2.555739 0.999756 3.378381 9.206961 0.506127 1.222917 -0.723831 0.008263 0.023157 0.010217 0.026625 0.001609 0.002620 0.000246 -0.015829 0.009095 -0.010100 0.003460 0.006641 1.717145 1.518489 0.088490 0.091950 2.017690 0.299491 1.615255 -0.000002 14 H 0.992696 16.173366 20.907708 0.090884 1.077479 0.85257361E+01 0.85814529E+02 1.789064 1.741680 -1.198327 2.295304 0.993026 3.930737 11.476651 0.456080 1.334247 -0.695254 -0.026549 0.003418 -0.017937 0.032223 0.001825 0.000921 0.000343 0.004825 0.006257 -0.004068 0.001050 0.003018 1.830537 2.158355 -0.011998 0.395461 1.664490 0.069607 1.668767 0.000001 15 H 2.466117 16.222228 23.351397 0.117098 1.158538 0.95208302E+01 0.95869945E+02 1.718136 1.721840 -0.728980 2.525129 0.999550 3.320650 8.873325 0.520902 1.167729 -0.738625 0.025679 0.005439 0.010660 0.028331 -0.001052 0.002954 0.003604 0.009738 0.013967 -0.008516 0.001361 0.007155 1.693856 1.873653 -0.057562 0.260295 1.573736 -0.034174 1.634178 0.000004 16 H 1.105697 15.461608 23.164244 0.107100 1.122182 0.84922841E+01 0.83382747E+02 1.692479 1.629884 -0.654372 2.548256 0.999729 3.360561 8.965098 0.531783 1.173060 -0.735314 -0.014581 -0.017628 0.007080 0.023948 0.001475 -0.005374 0.002597 -0.001592 -0.000697 -0.006893 0.001761 0.005132 1.730854 1.509634 0.313570 -0.117655 2.201403 -0.252610 1.481524 0.000002 17 H 3.900538 1.306248 24.212303 0.112592 1.179591 0.88102847E+01 0.86718331E+02 1.695391 1.615704 -0.999909 2.387087 0.998135 3.371407 8.809357 0.560042 1.111130 -0.750384 -0.000131 -0.002959 0.034613 0.034739 0.004715 -0.003603 -0.014677 0.002728 0.021701 -0.015083 -0.003464 0.018547 1.718230 1.320690 -0.004409 -0.098136 1.591003 0.203439 2.242995 0.000003 18 H 3.103262 1.211781 22.862125 0.089583 1.179694 0.92831663E+01 0.92563321E+02 1.705655 1.669599 -0.678653 2.532006 0.999706 3.379512 8.884218 0.545512 1.126054 -0.747980 -0.023446 -0.000226 -0.011851 0.026272 -0.000654 0.002485 -0.004863 -0.002859 -0.017765 -0.008295 0.001505 0.006790 1.711655 2.081967 0.073345 0.323381 1.461381 0.070587 1.591617 0.000004 19 H 4.197167 2.465909 20.803437 0.088190 1.054618 0.79904700E+01 0.77438986E+02 1.634446 1.587543 -0.599131 2.569671 0.999897 3.396730 9.067154 0.534329 1.182797 -0.732195 -0.025147 0.000469 -0.015113 0.029343 -0.005992 0.000774 0.000929 0.013226 0.008355 -0.010416 0.002853 0.007563 1.655026 1.947781 -0.009259 0.427609 1.399274 0.021006 1.618023 0.000001 20 H 5.566527 3.176039 21.089515 0.109237 1.204211 0.90815387E+01 0.90562088E+02 1.752799 1.666086 -1.067577 2.353402 0.997347 3.499046 9.368480 0.535861 1.146217 -0.740516 0.022527 0.022518 -0.009154 0.033141 0.003855 -0.008859 -0.010751 0.008449 0.022355 -0.013510 -0.004713 0.018223 1.790275 1.639610 0.377122 -0.120956 2.209654 -0.006754 1.521561 0.000001 21 H 5.860314 1.122200 19.926490 0.108485 1.061427 0.80955878E+01 0.79050141E+02 1.670910 1.623582 -0.655036 2.550837 0.999716 3.402759 9.245082 0.513713 1.221044 -0.723308 -0.003360 -0.001224 -0.024904 0.025160 -0.000347 0.001266 0.001118 -0.013288 0.016354 -0.009492 0.003391 0.006101 1.688394 1.509891 -0.016953 -0.228808 1.427586 0.042705 2.127706 0.000002 22 H 6.657018 1.143374 21.276668 0.112471 1.182530 0.97011910E+01 0.99157894E+02 1.805336 1.786698 -0.854010 2.461591 0.998253 3.530299 9.828354 0.485619 1.233981 -0.721066 0.022471 0.000520 0.017349 0.028394 0.003477 0.005530 0.000524 0.009492 -0.017533 -0.007903 -0.002699 0.010603 1.805361 2.236813 -0.015133 0.087724 1.608336 0.027908 1.570935 0.000002 23 H 1.942263 5.244536 2.299313 0.091366 1.146053 0.93006681E+01 0.94233975E+02 1.769305 1.747046 -0.870954 2.446398 0.997485 3.640420 10.149106 0.491233 1.230625 -0.720281 -0.027513 0.011231 -0.011007 0.031690 -0.000486 -0.001209 0.000468 0.001056 -0.019085 -0.006523 0.002463 0.004060 1.784389 2.109926 -0.309980 0.011080 1.595154 -0.045738 1.648087 -0.000001 24 H 4.779837 5.483960 2.299313 0.111408 1.171495 0.96388981E+01 0.99088314E+02 1.842033 1.818242 -0.956742 2.415420 0.996544 3.662756 10.474927 0.463238 1.286196 -0.708408 0.021422 -0.012328 0.003397 0.024949 0.000065 -0.000318 -0.003514 0.014148 -0.012423 -0.008115 -0.001039 0.009154 1.857394 2.212090 -0.076042 0.285491 1.602738 -0.051801 1.757354 -0.000001 25 H 3.805929 6.697370 2.518550 0.108585 1.100473 0.84300155E+01 0.82737922E+02 1.683152 1.635332 -0.651457 2.553013 0.999682 3.344210 8.961609 0.524584 1.189638 -0.731687 -0.008342 0.020892 0.012606 0.025787 -0.003651 -0.004172 0.002272 -0.008557 0.013281 -0.008653 0.000755 0.007898 1.702324 1.464403 0.018596 -0.007161 1.953683 0.365469 1.688885 -0.000003 26 H 2.307832 2.925213 2.088097 0.113936 1.132894 0.86967299E+01 0.85659603E+02 1.692715 1.643062 -0.666983 2.550806 0.999746 3.282042 8.689695 0.534199 1.164081 -0.738791 -0.024001 -0.012029 0.006861 0.027710 0.006582 -0.002661 0.001565 0.004012 0.002593 -0.008212 0.001488 0.006725 1.709965 1.717797 0.367133 -0.221481 1.806510 -0.242078 1.605588 0.000002 27 H 3.860000 3.159751 2.074729 0.102482 1.263460 0.10632572E+02 0.11060562E+03 1.848375 1.839669 -0.895423 2.434724 0.997758 3.576785 9.872180 0.493281 1.193638 -0.730972 0.023270 -0.003618 0.001099 0.023576 -0.005947 -0.000256 0.006540 0.002986 -0.003477 -0.009178 0.000314 0.008864 1.840005 1.972336 -0.269456 0.194313 1.799752 -0.184411 1.747925 0.000001 28 H 2.071536 4.016467 0.042778 0.091312 1.189956 0.95729787E+01 0.96046168E+02 1.708310 1.691011 -0.696942 2.527886 0.999514 3.369923 8.843312 0.544999 1.120152 -0.750080 -0.023422 0.009297 -0.005674 0.025830 0.002195 -0.000126 -0.008118 -0.000649 -0.003480 -0.008525 0.000098 0.008427 1.695324 2.089503 -0.174644 0.178048 1.448425 -0.038718 1.548045 -0.000001 29 H 3.165439 2.902411 26.602519 0.106754 1.202598 0.90532407E+01 0.89779847E+02 1.721272 1.640960 -1.007059 2.380042 0.997868 3.423279 8.998770 0.553743 1.115381 -0.749150 0.009014 -0.032881 -0.008839 0.035221 0.004521 0.001476 -0.001956 -0.019461 -0.049469 -0.016803 -0.002243 0.019046 1.743004 1.387332 -0.124417 -0.187278 1.997653 0.371365 1.844028 0.000002 30 H 4.541466 6.624077 0.299445 0.104307 1.185572 0.90237285E+01 0.90379536E+02 1.774602 1.692370 -1.043313 2.364113 0.997416 3.588116 9.817392 0.513791 1.190243 -0.729209 0.028506 0.019180 -0.001914 0.034411 0.007207 0.004857 0.004587 -0.009198 -0.040093 -0.015021 -0.001570 0.016591 1.803431 1.877091 0.403424 -0.267458 1.733936 -0.145896 1.799266 -0.000002 31 H 2.980360 6.461203 0.363612 0.085585 1.148483 0.90976531E+01 0.90593499E+02 1.696747 1.669137 -0.702363 2.519402 0.999507 3.437927 9.142284 0.535615 1.148380 -0.741552 -0.024419 0.007803 -0.002912 0.025800 -0.002304 0.005170 0.005842 0.000759 0.009237 -0.008938 0.000794 0.008144 1.701273 1.982727 -0.348606 0.130917 1.602805 -0.097806 1.518288 -0.000003 32 H 1.925387 6.856986 8.395167 0.101065 1.081183 0.85012906E+01 0.85606905E+02 1.804955 1.750063 -1.164266 2.313970 0.993120 3.874810 11.359112 0.450224 1.350995 -0.692281 -0.035544 -0.003545 0.000265 0.035722 0.001162 0.000354 -0.001264 0.008033 -0.012231 -0.004733 -0.001490 0.006223 1.862275 2.317294 0.266957 0.029469 1.653548 0.068912 1.615982 -0.000001 33 H 3.925507 8.650226 7.560997 0.110228 1.038195 0.81470739E+01 0.80001454E+02 1.667723 1.645694 -0.769589 2.499125 0.998974 3.494080 9.646319 0.500360 1.246601 -0.716672 0.026013 0.005877 0.001484 0.026710 0.005197 -0.001656 -0.002449 0.004245 -0.017581 -0.006664 -0.002388 0.009052 1.677021 2.096583 0.127727 -0.190724 1.476713 0.006551 1.457769 -0.000002 34 H 2.574197 8.384742 6.807037 0.114811 1.109380 0.84595510E+01 0.83289489E+02 1.705230 1.648225 -0.753079 2.510563 0.999124 3.373801 9.122607 0.516590 1.204251 -0.727801 -0.014514 -0.004431 -0.022230 0.026915 -0.003379 0.003735 0.001754 -0.010932 0.014811 -0.010007 0.003778 0.006229 1.737288 1.644402 0.033178 0.381820 1.429059 0.096752 2.138403 -0.000003 35 H 1.358279 9.350584 8.555584 0.091803 1.148777 0.88607144E+01 0.87457483E+02 1.687512 1.640190 -0.652528 2.547399 0.999841 3.336065 8.767796 0.545038 1.138547 -0.744817 -0.026499 -0.008674 -0.000209 0.027884 0.000135 -0.000761 0.003168 0.009968 0.007847 -0.007315 0.002973 0.004342 1.711848 2.246517 0.160077 0.090453 1.450588 0.021614 1.438439 -0.000003 36 H 2.444545 10.381575 8.082353 0.106786 1.191629 0.89662122E+01 0.89018955E+02 1.731443 1.648406 -1.041867 2.361082 0.997835 3.481806 9.265086 0.542852 1.136451 -0.743001 0.007763 0.025342 -0.018950 0.032582 -0.004957 -0.000348 -0.010686 -0.001909 0.045190 -0.014630 -0.004910 0.019540 1.759038 1.420928 0.138119 0.036250 2.269173 -0.247259 1.587014 -0.000000 37 H 3.121415 8.396143 11.440420 0.106802 1.170233 0.87964108E+01 0.87219300E+02 1.735068 1.651958 -1.011514 2.374684 0.998250 3.499828 9.413239 0.530977 1.163385 -0.736100 0.016801 -0.001708 0.027095 0.031926 -0.007857 0.002383 -0.012698 -0.003431 0.022830 -0.014339 -0.003823 0.018161 1.769792 1.534643 0.130956 0.300522 1.557794 0.169244 2.216939 -0.000002 38 H 1.782007 8.102971 10.675765 0.089351 1.115993 0.84139480E+01 0.82717532E+02 1.707464 1.636098 -0.693919 2.527607 0.999434 3.465564 9.359670 0.522226 1.193026 -0.729605 -0.026667 -0.007497 0.000960 0.027717 -0.002521 -0.004867 -0.002703 0.002140 -0.015023 -0.008457 0.002315 0.006142 1.754708 2.262447 0.360548 -0.207542 1.541647 -0.074262 1.460028 -0.000003 39 H 4.359119 7.347236 9.785449 0.112384 1.053667 0.83383415E+01 0.82089151E+02 1.672640 1.657444 -0.681531 2.546235 0.999604 3.386911 9.263667 0.503582 1.235462 -0.720617 0.026524 0.009523 -0.003339 0.028379 0.001607 0.000032 0.003322 0.013818 -0.005860 -0.007936 -0.000152 0.008088 1.678708 2.153225 -0.009148 0.013121 1.441136 0.029496 1.441765 -0.000002 40 H 3.244449 6.348820 10.258680 0.112592 1.100006 0.85772923E+01 0.84878844E+02 1.709739 1.672469 -0.655604 2.555739 0.999756 3.378381 9.206960 0.506127 1.222917 -0.723831 -0.008263 -0.023157 0.010217 0.026625 0.001609 -0.002620 -0.000246 -0.015829 0.009095 -0.010100 0.003460 0.006641 1.717145 1.518489 0.088490 -0.091950 2.017690 -0.299491 1.615255 -0.000002 41 H -0.046600 0.114012 7.539608 0.090884 1.077479 0.85257366E+01 0.85814537E+02 1.789065 1.741680 -1.198327 2.295304 0.993026 3.930737 11.476652 0.456080 1.334247 -0.695254 0.026549 -0.003418 -0.017937 0.032223 0.001825 -0.000921 -0.000343 0.004825 0.006257 -0.004068 0.001050 0.003018 1.830538 2.158356 -0.011998 -0.395461 1.664490 -0.069607 1.668767 0.000001 42 H 6.668079 0.065150 9.983297 0.117098 1.158539 0.95208387E+01 0.95870055E+02 1.718138 1.721841 -0.728980 2.525129 0.999550 3.320651 8.873330 0.520902 1.167730 -0.738625 -0.025679 -0.005439 0.010660 0.028331 -0.001052 -0.002954 -0.003604 0.009738 0.013967 -0.008516 0.001361 0.007155 1.693857 1.873654 -0.057562 -0.260296 1.573737 0.034174 1.634179 0.000004 43 H -0.159601 0.825770 9.796144 0.107100 1.122181 0.84922800E+01 0.83382701E+02 1.692479 1.629884 -0.654372 2.548256 0.999729 3.360560 8.965096 0.531782 1.173061 -0.735314 0.014581 0.017628 0.007080 0.023948 0.001475 0.005374 -0.002597 -0.001592 -0.000697 -0.006893 0.001761 0.005132 1.730854 1.509634 0.313570 0.117655 2.201403 0.252610 1.481524 0.000002 44 H 5.233658 14.981130 10.844203 0.112592 1.179591 0.88102841E+01 0.86718326E+02 1.695391 1.615704 -0.999908 2.387087 0.998135 3.371407 8.809358 0.560042 1.111130 -0.750384 0.000131 0.002959 0.034613 0.034739 0.004715 0.003603 0.014677 0.002728 0.021701 -0.015083 -0.003464 0.018547 1.718230 1.320690 -0.004409 0.098136 1.591003 -0.203439 2.242995 0.000003 45 H -2.157166 15.075597 9.494025 0.089583 1.179695 0.92831696E+01 0.92563370E+02 1.705656 1.669599 -0.678653 2.532006 0.999706 3.379512 8.884221 0.545511 1.126055 -0.747979 0.023446 0.000226 -0.011851 0.026272 -0.000654 -0.002485 0.004863 -0.002859 -0.017765 -0.008296 0.001505 0.006790 1.711656 2.081968 0.073345 -0.323381 1.461382 -0.070587 1.591617 0.000004 46 H 4.937029 13.821469 7.435337 0.088190 1.054618 0.79904700E+01 0.77438986E+02 1.634446 1.587543 -0.599131 2.569671 0.999897 3.396730 9.067154 0.534329 1.182797 -0.732195 0.025147 -0.000469 -0.015113 0.029343 -0.005992 -0.000774 -0.000929 0.013226 0.008355 -0.010416 0.002853 0.007563 1.655026 1.947781 -0.009259 -0.427609 1.399274 -0.021006 1.618023 0.000001 47 H 3.567669 13.111339 7.721415 0.109237 1.204211 0.90815389E+01 0.90562093E+02 1.752799 1.666087 -1.067577 2.353402 0.997347 3.499046 9.368481 0.535861 1.146217 -0.740516 -0.022527 -0.022518 -0.009154 0.033141 0.003855 0.008859 0.010751 0.008449 0.022355 -0.013510 -0.004713 0.018223 1.790275 1.639610 0.377122 0.120956 2.209654 0.006754 1.521561 0.000001 48 H 3.273882 15.165178 6.558390 0.108485 1.061427 0.80955880E+01 0.79050141E+02 1.670909 1.623582 -0.655036 2.550837 0.999716 3.402759 9.245081 0.513713 1.221043 -0.723308 0.003360 0.001224 -0.024904 0.025160 -0.000347 -0.001266 -0.001118 -0.013288 0.016354 -0.009492 0.003391 0.006101 1.688394 1.509891 -0.016953 0.228808 1.427586 -0.042705 2.127705 0.000002 49 H 2.477178 15.144004 7.908568 0.112472 1.182530 0.97011939E+01 0.99157931E+02 1.805336 1.786698 -0.854011 2.461590 0.998253 3.530300 9.828357 0.485619 1.233981 -0.721066 -0.022471 -0.000520 0.017349 0.028394 0.003477 -0.005530 -0.000524 0.009492 -0.017533 -0.007903 -0.002699 0.010603 1.805361 2.236813 -0.015133 -0.087724 1.608335 -0.027908 1.570935 0.000002 50 H -0.996167 11.042842 15.667413 0.091366 1.146053 0.93006667E+01 0.94233958E+02 1.769305 1.747045 -0.870954 2.446398 0.997485 3.640420 10.149106 0.491233 1.230625 -0.720281 0.027513 -0.011231 -0.011007 0.031690 -0.000486 0.001209 -0.000468 0.001056 -0.019085 -0.006523 0.002463 0.004060 1.784389 2.109925 -0.309980 -0.011080 1.595154 0.045738 1.648087 -0.000001 51 H 4.354359 10.803418 15.667413 0.111408 1.171495 0.96388969E+01 0.99088296E+02 1.842033 1.818241 -0.956742 2.415420 0.996544 3.662756 10.474926 0.463238 1.286196 -0.708408 -0.021422 0.012328 0.003397 0.024949 0.000065 0.000318 0.003514 0.014148 -0.012423 -0.008115 -0.001039 0.009154 1.857393 2.212089 -0.076041 -0.285491 1.602738 0.051801 1.757353 -0.000001 52 H 5.328267 9.590008 15.886650 0.108585 1.100473 0.84300153E+01 0.82737918E+02 1.683152 1.635332 -0.651457 2.553013 0.999682 3.344210 8.961608 0.524584 1.189638 -0.731687 0.008342 -0.020892 0.012606 0.025787 -0.003651 0.004172 -0.002272 -0.008557 0.013281 -0.008653 0.000755 0.007898 1.702323 1.464403 0.018596 0.007161 1.953683 -0.365469 1.688885 -0.000003 53 H -1.361736 13.362165 15.456197 0.113936 1.132894 0.86967317E+01 0.85659621E+02 1.692715 1.643062 -0.666984 2.550806 0.999746 3.282043 8.689696 0.534199 1.164081 -0.738791 0.024001 0.012029 0.006861 0.027709 0.006582 0.002661 -0.001565 0.004012 0.002593 -0.008212 0.001488 0.006725 1.709965 1.717797 0.367133 0.221480 1.806510 0.242078 1.605587 0.000002 54 H 5.274196 13.127627 15.442829 0.102482 1.263460 0.10632573E+02 0.11060563E+03 1.848374 1.839669 -0.895423 2.434724 0.997758 3.576786 9.872180 0.493282 1.193637 -0.730972 -0.023270 0.003618 0.001099 0.023576 -0.005947 0.000256 -0.006540 0.002986 -0.003477 -0.009178 0.000314 0.008864 1.840004 1.972336 -0.269456 -0.194312 1.799752 0.184411 1.747924 0.000001 55 H -1.125440 12.270911 13.410878 0.091312 1.189957 0.95729851E+01 0.96046251E+02 1.708310 1.691012 -0.696942 2.527886 0.999514 3.369924 8.843316 0.544999 1.120152 -0.750080 0.023422 -0.009297 -0.005674 0.025830 0.002195 0.000126 0.008118 -0.000649 -0.003480 -0.008525 0.000098 0.008427 1.695325 2.089504 -0.174644 -0.178048 1.448426 0.038718 1.548046 -0.000001 56 H -2.219343 13.384967 13.234419 0.106754 1.202599 0.90532455E+01 0.89779909E+02 1.721272 1.640960 -1.007059 2.380042 0.997868 3.423280 8.998774 0.553743 1.115381 -0.749150 -0.009014 0.032881 -0.008839 0.035221 0.004521 -0.001476 0.001956 -0.019461 -0.049469 -0.016803 -0.002243 0.019046 1.743005 1.387332 -0.124417 0.187278 1.997654 -0.371366 1.844029 0.000002 57 H 4.592730 9.663301 13.667545 0.104307 1.185572 0.90237287E+01 0.90379535E+02 1.774602 1.692369 -1.043313 2.364113 0.997416 3.588116 9.817391 0.513791 1.190243 -0.729209 -0.028506 -0.019180 -0.001914 0.034411 0.007207 -0.004857 -0.004587 -0.009198 -0.040093 -0.015021 -0.001570 0.016591 1.803431 1.877091 0.403424 0.267458 1.733936 0.145896 1.799266 -0.000002 58 H 6.153836 9.826175 13.731712 0.085585 1.148483 0.90976528E+01 0.90593492E+02 1.696747 1.669137 -0.702363 2.519402 0.999507 3.437927 9.142283 0.535615 1.148380 -0.741552 0.024419 -0.007803 -0.002912 0.025800 -0.002304 -0.005170 -0.005842 0.000760 0.009237 -0.008938 0.000794 0.008144 1.701273 1.982727 -0.348606 -0.130917 1.602805 0.097806 1.518288 -0.000003 59 H 6.019437 6.856986 4.972933 0.101065 1.081183 0.85012906E+01 0.85606905E+02 1.804955 1.750063 -1.164266 2.313970 0.993120 3.874810 11.359112 0.450224 1.350995 -0.692281 -0.035544 -0.003545 -0.000265 0.035722 0.001162 -0.000354 0.001264 0.008033 -0.012231 -0.004733 -0.001490 0.006223 1.862275 2.317294 0.266957 -0.029469 1.653548 -0.068912 1.615982 -0.000001 60 H -0.168543 8.650226 5.807103 0.110228 1.038195 0.81470787E+01 0.80001509E+02 1.667723 1.645694 -0.769590 2.499125 0.998974 3.494081 9.646321 0.500360 1.246601 -0.716672 0.026013 0.005877 -0.001484 0.026710 0.005197 0.001656 0.002449 0.004245 -0.017581 -0.006664 -0.002388 0.009052 1.677021 2.096583 0.127727 0.190724 1.476713 -0.006551 1.457769 -0.000002 61 H -1.519853 8.384742 6.561063 0.114810 1.109380 0.84595523E+01 0.83289509E+02 1.705231 1.648226 -0.753079 2.510563 0.999124 3.373801 9.122609 0.516590 1.204252 -0.727801 -0.014514 -0.004431 0.022230 0.026915 -0.003379 -0.003735 -0.001754 -0.010932 0.014811 -0.010007 0.003778 0.006229 1.737289 1.644403 0.033178 -0.381820 1.429060 -0.096752 2.138404 -0.000003 62 H 5.452329 9.350584 4.812516 0.091803 1.148777 0.88607149E+01 0.87457492E+02 1.687512 1.640190 -0.652528 2.547399 0.999841 3.336065 8.767797 0.545038 1.138547 -0.744817 -0.026499 -0.008674 0.000209 0.027884 0.000135 0.000761 -0.003168 0.009968 0.007847 -0.007315 0.002973 0.004342 1.711848 2.246517 0.160077 -0.090454 1.450588 -0.021614 1.438439 -0.000003 63 H -1.649505 10.381575 5.285747 0.106786 1.191629 0.89662119E+01 0.89018946E+02 1.731443 1.648406 -1.041867 2.361082 0.997835 3.481806 9.265084 0.542853 1.136451 -0.743001 0.007763 0.025342 0.018950 0.032582 -0.004957 0.000348 0.010686 -0.001909 0.045190 -0.014630 -0.004910 0.019540 1.759038 1.420927 0.138119 -0.036250 2.269172 0.247259 1.587013 -0.000000 64 H -0.972635 8.396143 1.927680 0.106802 1.170233 0.87964120E+01 0.87219317E+02 1.735068 1.651958 -1.011514 2.374684 0.998250 3.499828 9.413240 0.530976 1.163386 -0.736100 0.016801 -0.001708 -0.027095 0.031926 -0.007857 -0.002383 0.012698 -0.003431 0.022830 -0.014339 -0.003823 0.018161 1.769792 1.534643 0.130956 -0.300522 1.557794 -0.169244 2.216940 -0.000002 65 H 5.876057 8.102971 2.692335 0.089351 1.115993 0.84139480E+01 0.82717532E+02 1.707464 1.636098 -0.693919 2.527607 0.999434 3.465564 9.359670 0.522226 1.193026 -0.729605 -0.026667 -0.007497 -0.000960 0.027717 -0.002521 0.004867 0.002703 0.002140 -0.015023 -0.008457 0.002315 0.006142 1.754708 2.262447 0.360548 0.207542 1.541647 0.074262 1.460028 -0.000003 66 H 0.265069 7.347236 3.582651 0.112384 1.053667 0.83383459E+01 0.82089201E+02 1.672640 1.657444 -0.681532 2.546235 0.999604 3.386912 9.263669 0.503583 1.235462 -0.720617 0.026524 0.009523 0.003339 0.028379 0.001607 -0.000032 -0.003322 0.013818 -0.005860 -0.007936 -0.000152 0.008088 1.678709 2.153225 -0.009148 -0.013121 1.441136 -0.029496 1.441765 -0.000002 67 H -0.849601 6.348820 3.109420 0.112592 1.100006 0.85772938E+01 0.84878867E+02 1.709740 1.672469 -0.655604 2.555739 0.999756 3.378381 9.206962 0.506127 1.222918 -0.723831 -0.008263 -0.023157 -0.010217 0.026625 0.001609 0.002620 0.000246 -0.015829 0.009095 -0.010100 0.003460 0.006641 1.717145 1.518490 0.088490 0.091950 2.017690 0.299491 1.615255 -0.000002 68 H 4.047450 0.114012 5.828492 0.090884 1.077479 0.85257361E+01 0.85814529E+02 1.789064 1.741680 -1.198327 2.295304 0.993026 3.930737 11.476651 0.456080 1.334247 -0.695254 0.026549 -0.003418 0.017937 0.032223 0.001825 0.000921 0.000343 0.004825 0.006257 -0.004068 0.001050 0.003018 1.830537 2.158355 -0.011998 0.395461 1.664490 0.069607 1.668767 0.000001 69 H 2.574029 0.065150 3.384803 0.117098 1.158539 0.95208472E+01 0.95870167E+02 1.718139 1.721842 -0.728981 2.525129 0.999550 3.320652 8.873335 0.520902 1.167730 -0.738624 -0.025679 -0.005439 -0.010660 0.028331 -0.001052 0.002954 0.003604 0.009738 0.013967 -0.008516 0.001361 0.007155 1.693858 1.873656 -0.057562 0.260296 1.573738 -0.034174 1.634180 0.000004 70 H 3.934449 0.825770 3.571956 0.107099 1.122182 0.84922857E+01 0.83382772E+02 1.692480 1.629885 -0.654372 2.548256 0.999729 3.360561 8.965100 0.531782 1.173061 -0.735313 0.014581 0.017628 -0.007080 0.023948 0.001475 -0.005374 0.002597 -0.001592 -0.000697 -0.006893 0.001761 0.005132 1.730855 1.509635 0.313570 -0.117655 2.201405 -0.252610 1.481525 0.000002 71 H 1.139608 14.981130 2.523897 0.112592 1.179592 0.88102944E+01 0.86718454E+02 1.695392 1.615705 -0.999909 2.387087 0.998135 3.371409 8.809365 0.560041 1.111130 -0.750384 0.000131 0.002959 -0.034613 0.034739 0.004715 -0.003603 -0.014677 0.002728 0.021701 -0.015083 -0.003464 0.018547 1.718231 1.320691 -0.004409 -0.098137 1.591004 0.203439 2.242997 0.000003 72 H 1.936884 15.075597 3.874075 0.089583 1.179695 0.92831716E+01 0.92563397E+02 1.705656 1.669600 -0.678654 2.532006 0.999706 3.379512 8.884222 0.545511 1.126055 -0.747979 0.023446 0.000226 0.011851 0.026272 -0.000654 0.002485 -0.004863 -0.002859 -0.017765 -0.008295 0.001505 0.006790 1.711656 2.081968 0.073345 0.323381 1.461382 0.070587 1.591618 0.000004 73 H 0.842979 13.821469 5.932763 0.088190 1.054618 0.79904666E+01 0.77438950E+02 1.634446 1.587543 -0.599131 2.569671 0.999897 3.396729 9.067153 0.534329 1.182797 -0.732194 0.025147 -0.000469 0.015113 0.029343 -0.005992 0.000774 0.000929 0.013226 0.008355 -0.010416 0.002853 0.007563 1.655026 1.947781 -0.009259 0.427609 1.399274 0.021006 1.618023 0.000001 74 H -0.526381 13.111339 5.646685 0.109237 1.204211 0.90815375E+01 0.90562073E+02 1.752799 1.666086 -1.067576 2.353402 0.997347 3.499046 9.368480 0.535861 1.146217 -0.740516 -0.022527 -0.022518 0.009154 0.033141 0.003855 -0.008859 -0.010751 0.008449 0.022355 -0.013510 -0.004713 0.018223 1.790275 1.639610 0.377122 -0.120956 2.209654 -0.006754 1.521561 0.000001 75 H -0.820168 15.165178 6.809710 0.108485 1.061427 0.80955881E+01 0.79050140E+02 1.670909 1.623581 -0.655036 2.550837 0.999716 3.402759 9.245080 0.513713 1.221043 -0.723308 0.003360 0.001224 0.024904 0.025160 -0.000347 0.001266 0.001118 -0.013288 0.016354 -0.009492 0.003391 0.006101 1.688394 1.509891 -0.016953 -0.228808 1.427585 0.042705 2.127705 0.000002 76 H -1.616872 15.144004 5.459532 0.112472 1.182530 0.97011881E+01 0.99157858E+02 1.805336 1.786698 -0.854010 2.461591 0.998253 3.530299 9.828354 0.485619 1.233981 -0.721066 -0.022471 -0.000520 -0.017349 0.028394 0.003477 0.005530 0.000524 0.009492 -0.017533 -0.007903 -0.002699 0.010603 1.805360 2.236812 -0.015133 0.087724 1.608335 0.027908 1.570934 0.000002 77 H 3.097883 11.042842 24.436887 0.091366 1.146053 0.93006690E+01 0.94233991E+02 1.769306 1.747046 -0.870955 2.446398 0.997485 3.640420 10.149108 0.491232 1.230625 -0.720281 0.027513 -0.011231 0.011007 0.031690 -0.000486 -0.001209 0.000468 0.001056 -0.019085 -0.006523 0.002463 0.004060 1.784389 2.109926 -0.309980 0.011080 1.595154 -0.045738 1.648088 -0.000001 78 H 0.260309 10.803418 24.436887 0.111408 1.171495 0.96388982E+01 0.99088314E+02 1.842033 1.818242 -0.956742 2.415420 0.996544 3.662756 10.474927 0.463238 1.286196 -0.708408 -0.021422 0.012328 -0.003397 0.024949 0.000065 -0.000318 -0.003514 0.014148 -0.012423 -0.008115 -0.001039 0.009154 1.857394 2.212090 -0.076042 0.285491 1.602738 -0.051801 1.757354 -0.000001 79 H 1.234217 9.590008 24.217650 0.108585 1.100473 0.84300155E+01 0.82737922E+02 1.683152 1.635332 -0.651457 2.553013 0.999682 3.344210 8.961609 0.524584 1.189638 -0.731687 0.008342 -0.020892 -0.012606 0.025787 -0.003651 -0.004172 0.002272 -0.008557 0.013281 -0.008653 0.000755 0.007898 1.702324 1.464403 0.018596 -0.007161 1.953683 0.365469 1.688885 -0.000003 80 H 2.732314 13.362165 24.648103 0.113936 1.132894 0.86967359E+01 0.85659679E+02 1.692716 1.643063 -0.666984 2.550806 0.999746 3.282043 8.689699 0.534198 1.164081 -0.738791 0.024001 0.012029 -0.006861 0.027709 0.006582 -0.002661 0.001565 0.004012 0.002593 -0.008212 0.001488 0.006725 1.709966 1.717798 0.367134 -0.221481 1.806511 -0.242079 1.605588 0.000002 81 H 1.180146 13.127627 24.661471 0.102482 1.263460 0.10632578E+02 0.11060570E+03 1.848375 1.839670 -0.895423 2.434724 0.997758 3.576786 9.872183 0.493281 1.193637 -0.730972 -0.023270 0.003618 -0.001099 0.023576 -0.005947 -0.000256 0.006540 0.002986 -0.003477 -0.009178 0.000314 0.008864 1.840005 1.972337 -0.269456 0.194313 1.799753 -0.184411 1.747925 0.000001 82 H 2.968610 12.270911 26.693422 0.091312 1.189956 0.95729787E+01 0.96046169E+02 1.708310 1.691011 -0.696942 2.527886 0.999514 3.369923 8.843312 0.544999 1.120152 -0.750080 0.023422 -0.009297 0.005674 0.025830 0.002195 -0.000126 -0.008118 -0.000649 -0.003480 -0.008525 0.000098 0.008427 1.695324 2.089503 -0.174644 0.178048 1.448425 -0.038718 1.548045 -0.000001 83 H 1.874707 13.384967 0.133681 0.106753 1.202599 0.90532477E+01 0.89779942E+02 1.721273 1.640961 -1.007059 2.380042 0.997868 3.423280 8.998776 0.553742 1.115382 -0.749150 -0.009014 0.032881 0.008839 0.035221 0.004521 0.001476 -0.001956 -0.019461 -0.049469 -0.016803 -0.002243 0.019046 1.743006 1.387333 -0.124418 -0.187278 1.997655 0.371366 1.844030 0.000002 84 H 0.498680 9.663301 26.436755 0.104307 1.185572 0.90237286E+01 0.90379535E+02 1.774602 1.692369 -1.043314 2.364113 0.997416 3.588116 9.817391 0.513791 1.190243 -0.729209 -0.028506 -0.019180 0.001914 0.034411 0.007207 0.004857 0.004587 -0.009198 -0.040093 -0.015021 -0.001570 0.016591 1.803431 1.877091 0.403424 -0.267458 1.733936 -0.145896 1.799266 -0.000002 85 H 2.059786 9.826175 26.372588 0.085585 1.148483 0.90976527E+01 0.90593492E+02 1.696747 1.669137 -0.702363 2.519402 0.999507 3.437927 9.142283 0.535615 1.148380 -0.741552 0.024419 -0.007803 0.002912 0.025800 -0.002304 0.005170 0.005842 0.000760 0.009237 -0.008938 0.000794 0.008144 1.701273 1.982727 -0.348606 0.130917 1.602805 -0.097806 1.518288 -0.000003 86 H 3.114759 9.430392 18.341033 0.101065 1.081183 0.85012906E+01 0.85606905E+02 1.804955 1.750063 -1.164266 2.313970 0.993120 3.874810 11.359112 0.450224 1.350995 -0.692281 0.035544 0.003545 -0.000265 0.035722 0.001162 0.000354 -0.001264 0.008033 -0.012231 -0.004733 -0.001490 0.006223 1.862275 2.317294 0.266957 0.029469 1.653548 0.068912 1.615982 -0.000001 87 H 1.114639 7.637152 19.175203 0.110228 1.038195 0.81470745E+01 0.80001465E+02 1.667724 1.645694 -0.769589 2.499125 0.998974 3.494080 9.646321 0.500359 1.246602 -0.716672 -0.026013 -0.005877 -0.001484 0.026710 0.005197 -0.001656 -0.002449 0.004245 -0.017581 -0.006664 -0.002388 0.009052 1.677022 2.096584 0.127727 -0.190724 1.476713 0.006551 1.457769 -0.000002 88 H 2.465949 7.902636 19.929163 0.114810 1.109380 0.84595523E+01 0.83289509E+02 1.705231 1.648226 -0.753079 2.510563 0.999124 3.373801 9.122609 0.516590 1.204252 -0.727801 0.014514 0.004431 0.022230 0.026915 -0.003379 0.003735 0.001754 -0.010932 0.014811 -0.010007 0.003778 0.006229 1.737289 1.644403 0.033178 0.381820 1.429060 0.096752 2.138404 -0.000003 89 H 3.681867 6.936794 18.180616 0.091803 1.148777 0.88607162E+01 0.87457507E+02 1.687512 1.640190 -0.652528 2.547399 0.999841 3.336065 8.767797 0.545038 1.138547 -0.744817 0.026499 0.008674 0.000209 0.027884 0.000135 -0.000761 0.003168 0.009968 0.007847 -0.007315 0.002973 0.004342 1.711848 2.246518 0.160077 0.090454 1.450588 0.021614 1.438439 -0.000003 90 H 2.595601 5.905803 18.653847 0.106786 1.191629 0.89662120E+01 0.89018951E+02 1.731443 1.648406 -1.041867 2.361082 0.997835 3.481806 9.265085 0.542853 1.136451 -0.743001 -0.007763 -0.025342 0.018950 0.032582 -0.004957 -0.000348 -0.010686 -0.001909 0.045190 -0.014630 -0.004910 0.019540 1.759038 1.420927 0.138119 0.036250 2.269173 -0.247259 1.587014 -0.000000 91 H 1.918731 7.891235 15.295780 0.106802 1.170233 0.87964120E+01 0.87219317E+02 1.735068 1.651958 -1.011514 2.374684 0.998250 3.499828 9.413240 0.530976 1.163386 -0.736100 -0.016801 0.001708 -0.027095 0.031926 -0.007857 0.002383 -0.012698 -0.003431 0.022830 -0.014339 -0.003823 0.018161 1.769792 1.534643 0.130956 0.300522 1.557794 0.169244 2.216940 -0.000002 92 H 3.258139 8.184407 16.060435 0.089351 1.115993 0.84139478E+01 0.82717533E+02 1.707464 1.636098 -0.693919 2.527607 0.999434 3.465564 9.359671 0.522226 1.193026 -0.729605 0.026667 0.007497 -0.000960 0.027717 -0.002521 -0.004867 -0.002703 0.002140 -0.015023 -0.008457 0.002315 0.006142 1.754708 2.262447 0.360548 -0.207542 1.541648 -0.074262 1.460028 -0.000003 93 H 0.681027 8.940142 16.950751 0.112384 1.053667 0.83383446E+01 0.82089184E+02 1.672640 1.657444 -0.681531 2.546235 0.999604 3.386912 9.263668 0.503583 1.235462 -0.720618 -0.026524 -0.009523 0.003339 0.028379 0.001607 0.000032 0.003322 0.013818 -0.005860 -0.007936 -0.000152 0.008088 1.678708 2.153225 -0.009148 0.013121 1.441136 0.029496 1.441765 -0.000002 94 H 1.795697 9.938558 16.477520 0.112592 1.100006 0.85772938E+01 0.84878867E+02 1.709740 1.672469 -0.655604 2.555739 0.999756 3.378381 9.206962 0.506127 1.222918 -0.723831 0.008263 0.023157 -0.010217 0.026625 0.001609 -0.002620 -0.000246 -0.015829 0.009095 -0.010100 0.003460 0.006641 1.717145 1.518490 0.088490 -0.091950 2.017690 -0.299491 1.615255 -0.000002 95 H -3.101354 16.173366 19.196592 0.090884 1.077479 0.85257369E+01 0.85814537E+02 1.789064 1.741680 -1.198327 2.295304 0.993026 3.930737 11.476650 0.456080 1.334246 -0.695254 -0.026549 0.003418 0.017937 0.032223 0.001825 -0.000921 -0.000343 0.004825 0.006257 -0.004068 0.001050 0.003018 1.830537 2.158355 -0.011998 -0.395461 1.664490 -0.069607 1.668767 0.000001 96 H -1.627933 16.222228 16.752903 0.117098 1.158539 0.95208401E+01 0.95870073E+02 1.718138 1.721841 -0.728981 2.525129 0.999550 3.320651 8.873330 0.520902 1.167730 -0.738625 0.025679 0.005439 -0.010660 0.028331 -0.001052 -0.002954 -0.003604 0.009738 0.013967 -0.008516 0.001361 0.007155 1.693857 1.873655 -0.057562 -0.260296 1.573737 0.034174 1.634179 0.000004 97 H -2.988353 15.461608 16.940056 0.107099 1.122182 0.84922839E+01 0.83382743E+02 1.692479 1.629884 -0.654372 2.548256 0.999729 3.360561 8.965097 0.531783 1.173060 -0.735314 -0.014581 -0.017628 -0.007080 0.023948 0.001475 0.005374 -0.002597 -0.001592 -0.000697 -0.006893 0.001761 0.005132 1.730854 1.509634 0.313570 0.117655 2.201403 0.252610 1.481524 0.000002 98 H -0.193512 1.306248 15.891997 0.112592 1.179591 0.88102885E+01 0.86718375E+02 1.695391 1.615704 -0.999909 2.387087 0.998135 3.371408 8.809359 0.560042 1.111129 -0.750384 -0.000131 -0.002959 -0.034613 0.034739 0.004715 0.003603 0.014677 0.002728 0.021701 -0.015083 -0.003464 0.018547 1.718230 1.320690 -0.004409 0.098136 1.591003 -0.203439 2.242995 0.000003 99 H 7.197312 1.211781 17.242175 0.089583 1.179695 0.92831702E+01 0.92563374E+02 1.705656 1.669599 -0.678653 2.532006 0.999706 3.379512 8.884220 0.545511 1.126055 -0.747979 -0.023446 -0.000226 0.011851 0.026272 -0.000654 -0.002485 0.004863 -0.002859 -0.017765 -0.008295 0.001505 0.006790 1.711655 2.081968 0.073345 -0.323381 1.461381 -0.070587 1.591617 0.000004 100 H 0.103117 2.465909 19.300863 0.088190 1.054618 0.79904657E+01 0.77438935E+02 1.634446 1.587543 -0.599131 2.569671 0.999897 3.396729 9.067151 0.534329 1.182797 -0.732195 -0.025147 0.000469 0.015113 0.029343 -0.005992 -0.000774 -0.000929 0.013226 0.008355 -0.010416 0.002853 0.007563 1.655025 1.947780 -0.009259 -0.427608 1.399274 -0.021006 1.618022 0.000001 101 H 1.472477 3.176039 19.014785 0.109237 1.204211 0.90815373E+01 0.90562068E+02 1.752799 1.666086 -1.067576 2.353402 0.997347 3.499046 9.368479 0.535861 1.146217 -0.740516 0.022527 0.022518 0.009154 0.033141 0.003855 0.008859 0.010751 0.008449 0.022355 -0.013510 -0.004713 0.018223 1.790274 1.639609 0.377122 0.120956 2.209653 0.006754 1.521561 0.000001 102 H 1.766264 1.122200 20.177810 0.108485 1.061427 0.80955883E+01 0.79050140E+02 1.670909 1.623581 -0.655036 2.550837 0.999716 3.402759 9.245079 0.513713 1.221043 -0.723308 -0.003360 -0.001224 0.024904 0.025160 -0.000347 -0.001266 -0.001118 -0.013288 0.016354 -0.009492 0.003391 0.006101 1.688394 1.509891 -0.016953 0.228808 1.427585 -0.042705 2.127705 0.000002 103 H 2.562968 1.143374 18.827632 0.112472 1.182530 0.97011955E+01 0.99157953E+02 1.805336 1.786698 -0.854011 2.461590 0.998253 3.530300 9.828358 0.485619 1.233981 -0.721066 0.022471 0.000520 -0.017349 0.028394 0.003477 -0.005530 -0.000524 0.009492 -0.017534 -0.007903 -0.002699 0.010603 1.805361 2.236813 -0.015133 -0.087724 1.608336 -0.027908 1.570935 0.000002 104 H 6.036313 5.244536 11.068787 0.091366 1.146053 0.93006688E+01 0.94233991E+02 1.769306 1.747046 -0.870955 2.446398 0.997485 3.640420 10.149109 0.491232 1.230625 -0.720281 -0.027513 0.011231 0.011007 0.031690 -0.000486 0.001209 -0.000468 0.001056 -0.019085 -0.006523 0.002463 0.004060 1.784390 2.109927 -0.309980 -0.011080 1.595154 0.045738 1.648088 -0.000001 105 H 0.685787 5.483960 11.068787 0.111408 1.171495 0.96388981E+01 0.99088314E+02 1.842033 1.818242 -0.956742 2.415420 0.996544 3.662756 10.474927 0.463238 1.286196 -0.708408 0.021422 -0.012328 -0.003397 0.024949 0.000065 0.000318 0.003514 0.014148 -0.012423 -0.008115 -0.001039 0.009154 1.857394 2.212090 -0.076041 -0.285491 1.602738 0.051801 1.757354 -0.000001 106 H -0.288121 6.697370 10.849550 0.108585 1.100474 0.84300180E+01 0.82737945E+02 1.683152 1.635332 -0.651457 2.553013 0.999682 3.344211 8.961609 0.524584 1.189637 -0.731687 -0.008342 0.020892 -0.012606 0.025787 -0.003651 0.004172 -0.002272 -0.008557 0.013281 -0.008653 0.000755 0.007898 1.702323 1.464403 0.018596 0.007161 1.953682 -0.365469 1.688884 -0.000003 107 H 6.401882 2.925213 11.280003 0.113936 1.132894 0.86967353E+01 0.85659669E+02 1.692715 1.643063 -0.666984 2.550806 0.999746 3.282043 8.689698 0.534199 1.164081 -0.738791 -0.024001 -0.012029 -0.006861 0.027710 0.006582 0.002661 -0.001565 0.004012 0.002593 -0.008212 0.001488 0.006725 1.709965 1.717798 0.367133 0.221481 1.806511 0.242078 1.605588 0.000002 108 H -0.234050 3.159751 11.293371 0.102482 1.263460 0.10632575E+02 0.11060565E+03 1.848375 1.839669 -0.895423 2.434724 0.997758 3.576786 9.872180 0.493282 1.193637 -0.730972 0.023270 -0.003618 -0.001099 0.023576 -0.005947 0.000256 -0.006540 0.002986 -0.003477 -0.009178 0.000314 0.008864 1.840004 1.972336 -0.269456 -0.194312 1.799752 0.184411 1.747924 0.000001 109 H 6.165586 4.016467 13.325322 0.091312 1.189956 0.95729802E+01 0.96046180E+02 1.708309 1.691011 -0.696942 2.527886 0.999514 3.369924 8.843312 0.545000 1.120151 -0.750081 -0.023422 0.009297 0.005674 0.025830 0.002195 0.000126 0.008118 -0.000649 -0.003480 -0.008525 0.000098 0.008427 1.695324 2.089502 -0.174644 -0.178048 1.448425 0.038718 1.548045 -0.000001 110 H 7.259489 2.902411 13.501781 0.106753 1.202599 0.90532507E+01 0.89779971E+02 1.721273 1.640961 -1.007060 2.380042 0.997868 3.423281 8.998776 0.553743 1.115381 -0.749150 0.009014 -0.032881 0.008839 0.035221 0.004521 -0.001476 0.001956 -0.019461 -0.049469 -0.016803 -0.002243 0.019046 1.743005 1.387332 -0.124417 0.187278 1.997654 -0.371366 1.844029 0.000002 111 H 0.447416 6.624077 13.068655 0.104307 1.185572 0.90237287E+01 0.90379535E+02 1.774602 1.692369 -1.043313 2.364113 0.997416 3.588116 9.817391 0.513791 1.190243 -0.729209 0.028506 0.019180 0.001914 0.034411 0.007207 -0.004857 -0.004587 -0.009198 -0.040093 -0.015021 -0.001570 0.016591 1.803431 1.877091 0.403424 0.267458 1.733936 0.145896 1.799266 -0.000002 112 H -1.113690 6.461203 13.004488 0.085585 1.148483 0.90976490E+01 0.90593451E+02 1.696747 1.669137 -0.702363 2.519402 0.999507 3.437926 9.142282 0.535615 1.148381 -0.741552 -0.024419 0.007803 0.002912 0.025800 -0.002304 -0.005170 -0.005842 0.000760 0.009237 -0.008938 0.000794 0.008144 1.701273 1.982727 -0.348606 -0.130917 1.602805 0.097806 1.518288 -0.000003 113 C 5.565966 10.270821 20.990591 0.665375 22.211103 0.25001876E+03 0.52153945E+04 7.534134 5.762028 -0.390946 1.941688 0.998614 22.249200 64.049350 0.589633 0.497977 -0.998791 -0.010109 0.053488 -0.021584 0.058557 0.004621 -0.075053 0.060024 0.013746 0.218576 -0.095311 -0.032798 0.128108 8.905066 9.285764 -0.892255 2.449425 10.626983 -3.051016 6.802452 -0.000001 114 C 2.521439 14.919238 20.966528 0.671298 21.943081 0.22974328E+03 0.46875594E+04 7.415656 5.490112 -0.173666 2.018286 0.999498 21.659608 61.467726 0.610171 0.491984 -1.002807 0.007336 -0.050668 -0.011841 0.052548 0.028335 0.002488 -0.068928 -0.012484 0.317207 -0.094474 -0.038146 0.132620 8.984815 8.915725 -1.096856 -0.310437 13.041224 2.816308 4.997498 0.000001 115 C 6.261553 9.192596 21.725836 -0.117862 29.461394 0.44356981E+03 0.10539126E+05 8.551784 7.142382 -0.475831 1.867853 0.996259 28.551331 84.025055 0.597734 0.431276 -1.049077 -0.025395 -0.087553 0.045620 0.101939 0.009747 -0.015192 0.013336 -0.018717 0.041047 -0.029185 0.004960 0.024225 9.846765 7.446828 -1.018513 0.342318 12.196182 -2.974029 9.897284 -0.000002 116 C 6.145993 7.858660 21.052084 -0.219753 25.852503 0.42358912E+03 0.99412500E+04 7.688736 6.876173 -0.092403 1.957527 0.998985 29.671698 86.563367 0.623490 0.418582 -1.057775 0.037014 0.017597 0.081633 0.091344 -0.011297 0.000691 0.008182 -0.052315 -0.001890 -0.028382 -0.002405 0.030787 8.302182 6.426119 -0.705790 0.261479 10.295073 -1.514680 8.185355 -0.000003 117 C 6.822304 6.765777 21.880906 -0.086797 24.426085 0.35963390E+03 0.80861365E+04 7.370490 6.312192 -0.065269 1.983557 0.999314 27.622298 78.376246 0.655684 0.415462 -1.061818 -0.066241 0.059094 0.039755 0.097265 -0.007219 -0.017507 -0.000853 -0.022786 0.101623 -0.034698 -0.003789 0.038486 8.138975 6.602666 0.013227 -1.083759 9.174288 -2.059912 8.639970 -0.000003 118 C 6.412367 7.975929 23.928899 -0.086097 24.562307 0.36157512E+03 0.81488821E+04 7.420801 6.343420 -0.037499 1.993888 0.999372 27.649424 78.802460 0.651219 0.417330 -1.059567 -0.039693 -0.015430 -0.085573 0.095584 -0.005569 0.004647 0.020116 -0.056831 0.027282 -0.034661 -0.003302 0.037963 8.183026 6.397452 0.682900 0.691595 10.298010 -0.983195 7.853615 -0.000005 119 C 5.732342 9.096501 23.169591 -0.210436 25.538075 0.42093558E+03 0.98517570E+04 7.605127 6.835850 0.058532 2.010944 0.998686 29.334757 85.131473 0.628648 0.416294 -1.060484 0.058973 -0.060792 -0.041957 0.094519 -0.006674 -0.006044 -0.005740 -0.021820 0.090575 -0.028816 -0.002736 0.031552 8.220121 6.534453 -0.974459 0.185034 9.011358 -1.981870 9.114552 -0.000004 120 C 5.646339 5.635433 23.733725 0.493201 29.316210 0.26788921E+03 0.56120629E+04 8.575617 5.647872 0.145694 2.085381 0.999632 22.973185 63.520739 0.654776 0.446525 -1.039820 -0.011812 -0.017563 0.009748 0.023303 -0.024974 0.019150 -0.015078 0.041076 -0.053061 -0.030104 -0.019510 0.049614 11.124260 6.999058 4.707307 -3.204339 15.453082 -2.439805 10.920639 -0.000001 121 C 1.871656 16.158708 21.351529 -0.119597 31.110649 0.45063731E+03 0.10720096E+05 8.816346 7.156779 -0.406727 1.889005 0.996976 28.362830 82.778587 0.604081 0.426225 -1.055052 0.028928 0.081813 0.055102 0.102793 0.021415 0.001168 -0.000115 -0.004575 0.085446 -0.035792 0.007273 0.028519 10.542590 7.453535 -1.117142 -0.911575 15.675045 2.787014 8.499190 0.000001 122 C 1.617453 16.236887 22.880840 -0.216516 26.235127 0.42436111E+03 0.99221048E+04 7.684376 6.814241 0.114341 2.024256 0.999104 29.323732 84.223545 0.638421 0.410328 -1.067533 -0.017204 0.067677 -0.057165 0.090244 -0.008508 -0.029476 0.004941 -0.015935 0.089783 -0.037217 -0.007122 0.044339 8.436915 5.960987 -1.080446 -0.876764 11.305943 1.332936 8.043816 0.000004 123 C 3.992240 1.242727 23.249800 -0.087000 25.110350 0.36993375E+03 0.83618480E+04 7.497844 6.388463 -0.081410 1.974518 0.999221 27.769605 78.547935 0.654979 0.413714 -1.064819 0.080310 0.008922 -0.049117 0.094561 0.010106 -0.024506 -0.020262 -0.053138 -0.023832 -0.041106 -0.003926 0.045032 8.415716 6.294501 -0.053878 -0.526133 11.826347 1.841707 7.126300 0.000004 124 C 4.849344 3.565307 23.487752 0.480648 31.297295 0.28318680E+03 0.60078446E+04 8.946237 5.789235 0.103438 2.064163 0.999666 23.357559 64.723335 0.650519 0.443814 -1.042727 0.000004 0.018087 0.008172 0.019848 -0.014733 0.032596 -0.008719 0.037058 -0.024776 -0.028900 -0.019070 0.047971 12.045020 5.693319 2.123264 -1.245996 17.504211 6.232227 12.937529 0.000001 125 C 2.790814 4.607699 4.071923 0.678255 21.070811 0.23439929E+03 0.47996871E+04 7.200794 5.548127 -0.165510 2.024791 0.999148 21.607245 61.140422 0.607410 0.492456 -1.004012 0.001737 -0.001158 0.065615 0.065649 -0.019465 -0.007548 0.049420 -0.163943 -0.208694 -0.082071 -0.049382 0.131453 8.483597 9.106811 1.060023 -0.893438 4.526336 -1.228079 11.817646 -0.000001 126 C 5.024160 2.402388 21.308751 -0.083350 25.429253 0.36766439E+03 0.83110145E+04 7.602970 6.387968 -0.044682 1.990115 0.999365 27.697620 78.755488 0.651026 0.416203 -1.061530 0.015622 -0.066077 0.067976 0.096078 -0.006229 -0.025617 -0.002673 -0.025886 0.092777 -0.039186 -0.001272 0.040458 8.640879 6.369706 -1.012532 -0.784848 10.664131 2.582558 8.888799 0.000002 127 C 5.767412 1.136859 20.891667 -0.220757 27.565553 0.43310953E+03 0.10213419E+05 8.025580 6.928802 -0.071034 1.961425 0.999120 29.823339 86.993941 0.624860 0.415671 -1.060442 -0.079140 -0.003168 0.051652 0.094557 0.006184 -0.006099 -0.010482 -0.059513 -0.013886 -0.029183 -0.006577 0.035760 9.051960 7.542433 -0.719935 -1.636279 12.265967 1.392888 7.347481 0.000003 128 C 4.516997 4.687507 25.394043 0.483061 31.484390 0.28599027E+03 0.60875279E+04 9.016142 5.842746 0.018761 2.037947 0.999818 23.407721 65.153504 0.642839 0.447625 -1.039604 0.008186 -0.003386 -0.020379 0.022221 -0.027799 0.015925 -0.003903 0.048456 -0.057036 -0.028824 -0.021317 0.050141 12.051892 7.499956 1.361712 -5.773804 9.386685 1.512305 19.269036 -0.000001 129 C 2.809920 4.873183 2.550633 -0.120119 30.176526 0.45850767E+03 0.10908297E+05 8.544270 7.138080 -0.258052 1.929311 0.997576 28.317067 81.512166 0.617801 0.416723 -1.065523 0.059592 -0.014777 -0.076397 0.098011 0.017238 -0.009616 0.016454 -0.006349 -0.072223 -0.035442 0.004953 0.030489 9.959028 7.542534 0.612069 -2.470962 7.660271 -0.724836 14.674280 -0.000002 130 C 3.908148 5.842282 2.069382 -0.227478 27.713580 0.43360181E+03 0.10245498E+05 8.071310 6.942894 -0.134513 1.936706 0.999267 30.158115 88.553451 0.621789 0.416890 -1.057849 -0.061260 -0.046138 -0.046581 0.089729 0.017991 -0.014060 -0.007761 -0.017378 0.033099 -0.027298 -0.000116 0.027414 9.108813 7.190111 1.347686 -0.611516 7.249178 -0.467505 12.887150 -0.000004 131 C 3.005382 3.544133 1.820735 -0.218924 26.450577 0.41881984E+03 0.97928268E+04 7.781840 6.795715 -0.038534 1.971833 0.998972 29.687870 86.199014 0.633506 0.413499 -1.061954 -0.007834 0.082532 -0.044867 0.094265 0.011151 -0.007627 0.024560 -0.032863 0.021587 -0.030846 -0.004095 0.034941 8.635966 5.777850 0.283029 -1.022863 7.679688 -0.375843 12.450359 0.000002 132 C 2.962379 3.741211 0.310140 -0.084998 24.903576 0.36254392E+03 0.81690697E+04 7.487226 6.334745 -0.120734 1.961786 0.999216 27.814676 79.040388 0.654885 0.415077 -1.061926 0.057355 0.054119 0.050022 0.093384 0.032305 -0.018553 -0.011021 -0.052173 -0.005186 -0.044352 -0.004596 0.048948 8.376355 6.439746 0.812935 -1.623884 6.670757 -0.605083 12.018562 0.000002 133 C 3.825023 6.039360 0.590870 -0.083725 25.243789 0.36578251E+03 0.82793906E+04 7.596523 6.384159 -0.141954 1.954317 0.999323 28.035029 80.448389 0.647612 0.417845 -1.057730 0.005052 -0.089513 0.032959 0.095522 0.017753 -0.004355 0.028561 -0.044627 0.021974 -0.037501 -0.006413 0.043914 8.633595 6.042847 0.080228 -0.948588 7.159168 0.677453 12.698768 -0.000006 134 C 3.568230 6.016557 7.622491 0.665375 22.211101 0.25001874E+03 0.52153938E+04 7.534134 5.762028 -0.390946 1.941688 0.998614 22.249199 64.049349 0.589633 0.497977 -0.998791 0.010109 -0.053488 -0.021584 0.058557 0.004621 0.075053 -0.060024 0.013746 0.218576 -0.095311 -0.032798 0.128108 8.905066 9.285764 -0.892255 -2.449425 10.626983 3.051016 6.802452 -0.000001 135 C 6.612757 1.368140 7.598428 0.671298 21.943080 0.22974327E+03 0.46875593E+04 7.415656 5.490112 -0.173666 2.018286 0.999498 21.659608 61.467729 0.610170 0.491984 -1.002807 -0.007336 0.050668 -0.011841 0.052548 0.028335 -0.002488 0.068928 -0.012484 0.317207 -0.094474 -0.038146 0.132620 8.984816 8.915725 -1.096856 0.310437 13.041224 -2.816309 4.997498 0.000001 136 C 2.872643 7.094782 8.357736 -0.117862 29.461395 0.44356981E+03 0.10539126E+05 8.551784 7.142381 -0.475831 1.867853 0.996259 28.551331 84.025054 0.597734 0.431276 -1.049077 0.025395 0.087553 0.045620 0.101939 0.009747 0.015192 -0.013336 -0.018717 0.041047 -0.029186 0.004960 0.024225 9.846764 7.446828 -1.018513 -0.342318 12.196182 2.974028 9.897283 -0.000002 137 C 2.988203 8.428718 7.683984 -0.219753 25.852501 0.42358908E+03 0.99412487E+04 7.688736 6.876173 -0.092403 1.957527 0.998985 29.671697 86.563365 0.623490 0.418582 -1.057775 -0.037014 -0.017597 0.081633 0.091344 -0.011297 -0.000691 -0.008182 -0.052315 -0.001890 -0.028382 -0.002405 0.030787 8.302182 6.426119 -0.705790 -0.261479 10.295072 1.514680 8.185355 -0.000004 138 C 2.311892 9.521601 8.512806 -0.086797 24.426087 0.35963394E+03 0.80861378E+04 7.370490 6.312192 -0.065270 1.983557 0.999314 27.622300 78.376254 0.655684 0.415462 -1.061818 0.066241 -0.059094 0.039755 0.097265 -0.007219 0.017507 0.000853 -0.022786 0.101623 -0.034698 -0.003789 0.038486 8.138975 6.602666 0.013227 1.083759 9.174289 2.059912 8.639971 -0.000003 139 C 2.721829 8.311449 10.560799 -0.086097 24.562305 0.36157510E+03 0.81488814E+04 7.420801 6.343420 -0.037499 1.993888 0.999372 27.649423 78.802457 0.651219 0.417330 -1.059567 0.039693 0.015430 -0.085573 0.095584 -0.005569 -0.004647 -0.020116 -0.056831 0.027282 -0.034661 -0.003302 0.037963 8.183026 6.397452 0.682900 -0.691595 10.298010 0.983195 7.853615 -0.000005 140 C 3.401854 7.190877 9.801491 -0.210436 25.538075 0.42093558E+03 0.98517571E+04 7.605127 6.835850 0.058532 2.010944 0.998686 29.334757 85.131473 0.628648 0.416294 -1.060484 -0.058973 0.060792 -0.041957 0.094519 -0.006674 0.006044 0.005740 -0.021820 0.090575 -0.028816 -0.002736 0.031552 8.220121 6.534453 -0.974459 -0.185034 9.011358 1.981870 9.114552 -0.000004 141 C 3.487857 10.651945 10.365625 0.493201 29.316208 0.26788919E+03 0.56120623E+04 8.575617 5.647872 0.145694 2.085381 0.999632 22.973184 63.520736 0.654776 0.446525 -1.039820 0.011812 0.017563 0.009748 0.023303 -0.024974 -0.019150 0.015078 0.041076 -0.053061 -0.030104 -0.019510 0.049614 11.124259 6.999058 4.707307 3.204339 15.453081 2.439805 10.920638 -0.000001 142 C 7.262540 0.128670 7.983429 -0.119597 31.110646 0.45063726E+03 0.10720095E+05 8.816345 7.156778 -0.406727 1.889005 0.996976 28.362828 82.778577 0.604081 0.426225 -1.055052 -0.028928 -0.081813 0.055102 0.102793 0.021415 -0.001168 0.000115 -0.004575 0.085446 -0.035792 0.007273 0.028519 10.542589 7.453535 -1.117142 0.911575 15.675043 -2.787014 8.499189 0.000001 143 C 7.516743 0.050491 9.512740 -0.216516 26.235127 0.42436112E+03 0.99221050E+04 7.684376 6.814241 0.114341 2.024256 0.999104 29.323733 84.223551 0.638421 0.410328 -1.067533 0.017204 -0.067677 -0.057165 0.090244 -0.008508 0.029476 -0.004941 -0.015935 0.089783 -0.037217 -0.007122 0.044339 8.436915 5.960987 -1.080446 0.876764 11.305943 -1.332936 8.043816 0.000004 144 C 5.141956 15.044651 9.881700 -0.087000 25.110350 0.36993375E+03 0.83618484E+04 7.497845 6.388464 -0.081409 1.974518 0.999221 27.769606 78.547944 0.654979 0.413714 -1.064819 -0.080310 -0.008921 -0.049117 0.094561 0.010106 0.024506 0.020262 -0.053138 -0.023832 -0.041106 -0.003926 0.045032 8.415717 6.294502 -0.053878 0.526132 11.826348 -1.841707 7.126301 0.000004 145 C 4.284852 12.722071 10.119652 0.480648 31.297296 0.28318682E+03 0.60078450E+04 8.946237 5.789235 0.103438 2.064163 0.999666 23.357560 64.723340 0.650519 0.443814 -1.042727 -0.000004 -0.018087 0.008172 0.019848 -0.014733 -0.032596 0.008719 0.037058 -0.024776 -0.028900 -0.019070 0.047971 12.045020 5.693320 2.123264 1.245996 17.504212 -6.232228 12.937530 0.000001 146 C -1.844718 11.679679 17.440023 0.678255 21.070812 0.23439929E+03 0.47996872E+04 7.200794 5.548127 -0.165510 2.024791 0.999148 21.607245 61.140421 0.607410 0.492456 -1.004012 -0.001737 0.001158 0.065615 0.065649 -0.019465 0.007548 -0.049420 -0.163943 -0.208694 -0.082071 -0.049382 0.131453 8.483598 9.106811 1.060023 0.893438 4.526336 1.228079 11.817647 -0.000001 147 C 4.110036 13.884990 7.940651 -0.083350 25.429254 0.36766441E+03 0.83110151E+04 7.602971 6.387968 -0.044682 1.990115 0.999365 27.697621 78.755493 0.651026 0.416203 -1.061530 -0.015622 0.066077 0.067976 0.096078 -0.006229 0.025617 0.002673 -0.025886 0.092777 -0.039186 -0.001272 0.040458 8.640879 6.369707 -1.012532 0.784848 10.664132 -2.582558 8.888799 0.000002 148 C 3.366784 15.150519 7.523567 -0.220757 27.565554 0.43310954E+03 0.10213420E+05 8.025581 6.928802 -0.071034 1.961425 0.999120 29.823340 86.993947 0.624860 0.415671 -1.060442 0.079140 0.003168 0.051652 0.094557 0.006184 0.006099 0.010482 -0.059513 -0.013886 -0.029183 -0.006577 0.035760 9.051961 7.542434 -0.719936 1.636280 12.265968 -1.392888 7.347482 0.000003 149 C 4.617199 11.599871 12.025943 0.483061 31.484388 0.28599024E+03 0.60875272E+04 9.016142 5.842746 0.018761 2.037947 0.999818 23.407720 65.153504 0.642839 0.447625 -1.039604 -0.008186 0.003386 -0.020379 0.022221 -0.027799 -0.015925 0.003903 0.048456 -0.057036 -0.028824 -0.021317 0.050141 12.051893 7.499956 1.361713 5.773805 9.386685 -1.512305 19.269037 -0.000001 150 C -1.863824 11.414195 15.918733 -0.120119 30.176530 0.45850772E+03 0.10908299E+05 8.544271 7.138080 -0.258052 1.929311 0.997576 28.317069 81.512176 0.617800 0.416723 -1.065523 -0.059592 0.014777 -0.076397 0.098011 0.017238 0.009616 -0.016454 -0.006349 -0.072223 -0.035442 0.004953 0.030489 9.959030 7.542534 0.612069 2.470962 7.660271 0.724836 14.674283 -0.000002 151 C 5.226048 10.445096 15.437482 -0.227478 27.713577 0.43360177E+03 0.10245497E+05 8.071310 6.942893 -0.134513 1.936706 0.999267 30.158113 88.553443 0.621789 0.416890 -1.057849 0.061260 0.046138 -0.046581 0.089729 0.017991 0.014060 0.007761 -0.017378 0.033099 -0.027298 -0.000116 0.027414 9.108813 7.190111 1.347686 0.611516 7.249178 0.467505 12.887150 -0.000004 152 C -2.059286 12.743245 15.188835 -0.218924 26.450576 0.41881981E+03 0.97928259E+04 7.781841 6.795716 -0.038534 1.971833 0.998972 29.687869 86.199012 0.633506 0.413499 -1.061954 0.007834 -0.082532 -0.044867 0.094265 0.011151 0.007627 -0.024560 -0.032863 0.021587 -0.030846 -0.004095 0.034941 8.635966 5.777850 0.283029 1.022863 7.679689 0.375843 12.450361 0.000002 153 C -2.016283 12.546167 13.678240 -0.084998 24.903575 0.36254391E+03 0.81690694E+04 7.487226 6.334745 -0.120734 1.961786 0.999216 27.814677 79.040394 0.654885 0.415077 -1.061926 -0.057355 -0.054119 0.050022 0.093384 0.032305 0.018553 0.011021 -0.052173 -0.005186 -0.044352 -0.004596 0.048948 8.376355 6.439746 0.812934 1.623884 6.670757 0.605082 12.018562 0.000002 154 C 5.309173 10.248018 13.958970 -0.083725 25.243789 0.36578249E+03 0.82793901E+04 7.596523 6.384159 -0.141954 1.954317 0.999323 28.035028 80.448385 0.647612 0.417845 -1.057730 -0.005052 0.089513 0.032959 0.095522 0.017753 0.004355 -0.028561 -0.044626 0.021974 -0.037501 -0.006413 0.043914 8.633595 6.042847 0.080228 0.948588 7.159168 -0.677453 12.698769 -0.000005 155 C -0.525820 6.016557 5.745609 0.665375 22.211102 0.25001876E+03 0.52153944E+04 7.534133 5.762028 -0.390946 1.941688 0.998614 22.249200 64.049350 0.589634 0.497977 -0.998791 0.010109 -0.053488 0.021584 0.058557 0.004621 -0.075053 0.060024 0.013746 0.218576 -0.095311 -0.032798 0.128108 8.905066 9.285764 -0.892256 2.449425 10.626982 -3.051016 6.802452 -0.000001 156 C 2.518707 1.368140 5.769672 0.671298 21.943080 0.22974327E+03 0.46875593E+04 7.415656 5.490112 -0.173666 2.018286 0.999498 21.659608 61.467727 0.610170 0.491984 -1.002807 -0.007336 0.050668 0.011841 0.052548 0.028335 0.002488 -0.068928 -0.012484 0.317207 -0.094474 -0.038146 0.132620 8.984816 8.915725 -1.096856 -0.310437 13.041224 2.816309 4.997498 0.000001 157 C -1.221407 7.094782 5.010364 -0.117862 29.461396 0.44356984E+03 0.10539126E+05 8.551784 7.142381 -0.475831 1.867853 0.996259 28.551331 84.025052 0.597734 0.431276 -1.049077 0.025395 0.087553 -0.045620 0.101939 0.009747 -0.015192 0.013336 -0.018717 0.041047 -0.029186 0.004960 0.024225 9.846764 7.446828 -1.018513 0.342318 12.196181 -2.974028 9.897283 -0.000002 158 C -1.105847 8.428718 5.684116 -0.219753 25.852498 0.42358902E+03 0.99412472E+04 7.688735 6.876172 -0.092403 1.957527 0.998985 29.671696 86.563359 0.623491 0.418582 -1.057775 -0.037014 -0.017597 -0.081633 0.091344 -0.011297 0.000691 0.008182 -0.052315 -0.001890 -0.028382 -0.002405 0.030787 8.302181 6.426118 -0.705790 0.261479 10.295070 -1.514679 8.185354 -0.000003 159 C -1.782158 9.521601 4.855294 -0.086797 24.426086 0.35963393E+03 0.80861372E+04 7.370490 6.312191 -0.065269 1.983557 0.999314 27.622299 78.376246 0.655684 0.415462 -1.061818 0.066241 -0.059094 -0.039755 0.097265 -0.007219 -0.017507 -0.000853 -0.022786 0.101623 -0.034698 -0.003789 0.038486 8.138974 6.602666 0.013227 -1.083759 9.174287 -2.059912 8.639970 -0.000003 160 C -1.372221 8.311449 2.807301 -0.086097 24.562306 0.36157512E+03 0.81488820E+04 7.420801 6.343420 -0.037499 1.993888 0.999372 27.649424 78.802461 0.651219 0.417330 -1.059567 0.039693 0.015430 0.085573 0.095584 -0.005569 0.004647 0.020116 -0.056831 0.027282 -0.034661 -0.003302 0.037963 8.183026 6.397452 0.682900 0.691595 10.298010 -0.983195 7.853616 -0.000005 161 C -0.692196 7.190877 3.566609 -0.210436 25.538071 0.42093548E+03 0.98517541E+04 7.605126 6.835849 0.058532 2.010945 0.998686 29.334754 85.131461 0.628648 0.416294 -1.060484 -0.058973 0.060792 0.041957 0.094519 -0.006674 -0.006044 -0.005740 -0.021820 0.090575 -0.028816 -0.002736 0.031552 8.220120 6.534452 -0.974459 0.185034 9.011357 -1.981869 9.114551 -0.000004 162 C -0.606193 10.651945 3.002475 0.493201 29.316208 0.26788919E+03 0.56120624E+04 8.575617 5.647872 0.145694 2.085381 0.999632 22.973184 63.520737 0.654776 0.446525 -1.039820 0.011812 0.017563 -0.009748 0.023303 -0.024974 0.019150 -0.015078 0.041076 -0.053061 -0.030104 -0.019510 0.049614 11.124259 6.999058 4.707308 -3.204339 15.453082 -2.439805 10.920638 -0.000001 163 C 3.168490 0.128670 5.384671 -0.119597 31.110651 0.45063733E+03 0.10720097E+05 8.816346 7.156779 -0.406727 1.889005 0.996976 28.362831 82.778591 0.604081 0.426225 -1.055052 -0.028928 -0.081813 -0.055102 0.102793 0.021415 0.001168 -0.000115 -0.004575 0.085446 -0.035792 0.007273 0.028519 10.542591 7.453535 -1.117142 -0.911575 15.675046 2.787015 8.499191 0.000001 164 C 3.422693 0.050491 3.855360 -0.216516 26.235123 0.42436102E+03 0.99221025E+04 7.684376 6.814240 0.114340 2.024256 0.999104 29.323732 84.223552 0.638421 0.410328 -1.067533 0.017204 -0.067677 0.057165 0.090244 -0.008508 -0.029476 0.004941 -0.015935 0.089783 -0.037217 -0.007122 0.044339 8.436914 5.960987 -1.080446 -0.876764 11.305942 1.332936 8.043815 0.000003 165 C 1.047906 15.044651 3.486400 -0.087000 25.110347 0.36993369E+03 0.83618466E+04 7.497844 6.388463 -0.081409 1.974518 0.999221 27.769605 78.547941 0.654979 0.413714 -1.064819 -0.080310 -0.008922 0.049117 0.094561 0.010106 -0.024506 -0.020262 -0.053138 -0.023831 -0.041106 -0.003926 0.045032 8.415716 6.294502 -0.053878 -0.526132 11.826346 1.841707 7.126301 0.000004 166 C 0.190802 12.722071 3.248448 0.480648 31.297297 0.28318681E+03 0.60078450E+04 8.946238 5.789236 0.103438 2.064163 0.999666 23.357560 64.723343 0.650519 0.443814 -1.042727 -0.000004 -0.018087 -0.008172 0.019848 -0.014733 0.032596 -0.008719 0.037058 -0.024776 -0.028900 -0.019070 0.047971 12.045021 5.693320 2.123264 -1.245996 17.504213 6.232228 12.937530 0.000001 167 C 2.249332 11.679679 22.664277 0.678255 21.070810 0.23439927E+03 0.47996867E+04 7.200794 5.548127 -0.165510 2.024791 0.999148 21.607244 61.140419 0.607410 0.492456 -1.004012 -0.001737 0.001158 -0.065615 0.065649 -0.019465 -0.007548 0.049420 -0.163943 -0.208694 -0.082071 -0.049382 0.131453 8.483597 9.106810 1.060023 -0.893437 4.526335 -1.228079 11.817646 -0.000001 168 C 0.015986 13.884990 5.427449 -0.083350 25.429257 0.36766446E+03 0.83110167E+04 7.602972 6.387969 -0.044682 1.990115 0.999365 27.697623 78.755504 0.651026 0.416203 -1.061530 -0.015622 0.066077 -0.067976 0.096078 -0.006229 -0.025617 -0.002673 -0.025886 0.092777 -0.039186 -0.001272 0.040458 8.640880 6.369707 -1.012532 -0.784849 10.664133 2.582559 8.888800 0.000002 169 C -0.727266 15.150519 5.844533 -0.220757 27.565556 0.43310959E+03 0.10213421E+05 8.025581 6.928803 -0.071034 1.961425 0.999120 29.823341 86.993951 0.624860 0.415671 -1.060442 0.079140 0.003168 -0.051652 0.094557 0.006184 -0.006099 -0.010482 -0.059513 -0.013886 -0.029183 -0.006577 0.035760 9.051962 7.542434 -0.719936 -1.636280 12.265970 1.392888 7.347482 0.000003 170 C 0.523149 11.599871 1.342157 0.483061 31.484390 0.28599026E+03 0.60875278E+04 9.016142 5.842746 0.018761 2.037947 0.999818 23.407721 65.153505 0.642839 0.447625 -1.039604 -0.008186 0.003386 0.020379 0.022221 -0.027799 0.015925 -0.003903 0.048456 -0.057036 -0.028824 -0.021317 0.050141 12.051892 7.499956 1.361713 -5.773804 9.386685 1.512305 19.269036 -0.000001 171 C 2.230226 11.414195 24.185567 -0.120119 30.176530 0.45850773E+03 0.10908299E+05 8.544270 7.138080 -0.258052 1.929311 0.997576 28.317069 81.512172 0.617801 0.416723 -1.065523 -0.059592 0.014777 0.076397 0.098011 0.017238 -0.009616 0.016454 -0.006349 -0.072223 -0.035442 0.004953 0.030489 9.959029 7.542534 0.612069 -2.470962 7.660271 -0.724836 14.674281 -0.000001 172 C 1.131998 10.445096 24.666818 -0.227478 27.713574 0.43360171E+03 0.10245495E+05 8.071309 6.942893 -0.134513 1.936706 0.999267 30.158111 88.553435 0.621789 0.416890 -1.057849 0.061260 0.046138 0.046581 0.089729 0.017991 -0.014060 -0.007761 -0.017378 0.033099 -0.027298 -0.000116 0.027414 9.108812 7.190111 1.347686 -0.611516 7.249177 -0.467505 12.887148 -0.000004 173 C 2.034764 12.743245 24.915465 -0.218924 26.450570 0.41881969E+03 0.97928226E+04 7.781839 6.795714 -0.038534 1.971833 0.998972 29.687866 86.199000 0.633506 0.413499 -1.061954 0.007834 -0.082532 0.044867 0.094265 0.011151 -0.007627 0.024560 -0.032863 0.021587 -0.030846 -0.004095 0.034941 8.635964 5.777849 0.283029 -1.022863 7.679687 -0.375843 12.450357 0.000002 174 C 2.077767 12.546167 26.426060 -0.084998 24.903572 0.36254385E+03 0.81690678E+04 7.487225 6.334744 -0.120734 1.961787 0.999216 27.814674 79.040382 0.654885 0.415077 -1.061926 -0.057355 -0.054119 -0.050022 0.093384 0.032305 -0.018553 -0.011021 -0.052173 -0.005187 -0.044352 -0.004596 0.048948 8.376354 6.439745 0.812934 -1.623884 6.670757 -0.605082 12.018560 0.000002 175 C 1.215123 10.248018 26.145330 -0.083725 25.243793 0.36578257E+03 0.82793922E+04 7.596523 6.384159 -0.141954 1.954317 0.999323 28.035031 80.448392 0.647612 0.417845 -1.057730 -0.005052 0.089513 -0.032959 0.095522 0.017753 -0.004355 0.028561 -0.044626 0.021974 -0.037501 -0.006413 0.043914 8.633595 6.042847 0.080228 -0.948588 7.159168 0.677453 12.698769 -0.000006 176 C 1.471916 10.270821 19.113709 0.665375 22.211102 0.25001876E+03 0.52153944E+04 7.534133 5.762028 -0.390946 1.941688 0.998614 22.249200 64.049351 0.589633 0.497977 -0.998791 -0.010109 0.053488 0.021584 0.058557 0.004621 0.075053 -0.060024 0.013746 0.218576 -0.095311 -0.032798 0.128108 8.905066 9.285764 -0.892256 -2.449425 10.626983 3.051016 6.802452 -0.000001 177 C -1.572611 14.919238 19.137772 0.671298 21.943080 0.22974326E+03 0.46875591E+04 7.415656 5.490112 -0.173666 2.018286 0.999498 21.659608 61.467728 0.610170 0.491984 -1.002807 0.007336 -0.050668 0.011841 0.052548 0.028335 -0.002488 0.068928 -0.012484 0.317207 -0.094474 -0.038146 0.132620 8.984816 8.915725 -1.096856 0.310437 13.041224 -2.816309 4.997498 0.000001 178 C 2.167503 9.192596 18.378464 -0.117863 29.461395 0.44356982E+03 0.10539126E+05 8.551784 7.142382 -0.475831 1.867853 0.996259 28.551331 84.025052 0.597734 0.431276 -1.049077 -0.025395 -0.087553 -0.045620 0.101939 0.009747 0.015192 -0.013336 -0.018717 0.041047 -0.029186 0.004960 0.024225 9.846764 7.446828 -1.018513 -0.342318 12.196182 2.974028 9.897284 -0.000002 179 C 2.051943 7.858660 19.052216 -0.219753 25.852498 0.42358901E+03 0.99412468E+04 7.688735 6.876172 -0.092403 1.957527 0.998985 29.671695 86.563354 0.623491 0.418581 -1.057775 0.037014 0.017597 -0.081633 0.091344 -0.011297 -0.000691 -0.008182 -0.052315 -0.001890 -0.028382 -0.002405 0.030787 8.302180 6.426118 -0.705789 -0.261479 10.295069 1.514679 8.185354 -0.000003 180 C 2.728254 6.765777 18.223394 -0.086797 24.426084 0.35963390E+03 0.80861364E+04 7.370489 6.312191 -0.065269 1.983557 0.999314 27.622298 78.376243 0.655684 0.415462 -1.061818 -0.066241 0.059094 -0.039755 0.097265 -0.007219 0.017507 0.000853 -0.022786 0.101623 -0.034698 -0.003789 0.038486 8.138974 6.602665 0.013227 1.083759 9.174287 2.059911 8.639970 -0.000003 181 C 2.318317 7.975929 16.175401 -0.086097 24.562306 0.36157511E+03 0.81488820E+04 7.420801 6.343420 -0.037499 1.993888 0.999372 27.649424 78.802461 0.651219 0.417330 -1.059567 -0.039693 -0.015430 0.085573 0.095584 -0.005569 -0.004647 -0.020116 -0.056831 0.027282 -0.034661 -0.003302 0.037963 8.183026 6.397452 0.682900 -0.691595 10.298010 0.983195 7.853616 -0.000005 182 C 1.638292 9.096501 16.934709 -0.210436 25.538071 0.42093549E+03 0.98517544E+04 7.605126 6.835849 0.058532 2.010945 0.998686 29.334754 85.131460 0.628648 0.416294 -1.060484 0.058973 -0.060792 0.041957 0.094519 -0.006674 0.006044 0.005740 -0.021820 0.090575 -0.028816 -0.002736 0.031552 8.220120 6.534452 -0.974459 -0.185034 9.011357 1.981869 9.114551 -0.000004 183 C 1.552289 5.635433 16.370575 0.493201 29.316208 0.26788919E+03 0.56120625E+04 8.575617 5.647872 0.145694 2.085381 0.999632 22.973184 63.520736 0.654776 0.446525 -1.039820 -0.011812 -0.017563 -0.009748 0.023303 -0.024974 -0.019150 0.015078 0.041076 -0.053061 -0.030104 -0.019510 0.049614 11.124259 6.999058 4.707307 3.204339 15.453081 2.439805 10.920638 -0.000001 184 C -2.222394 16.158708 18.752771 -0.119597 31.110654 0.45063740E+03 0.10720099E+05 8.816347 7.156779 -0.406727 1.889005 0.996976 28.362833 82.778597 0.604081 0.426225 -1.055052 0.028928 0.081813 -0.055102 0.102793 0.021415 -0.001168 0.000115 -0.004575 0.085446 -0.035792 0.007273 0.028519 10.542591 7.453536 -1.117142 0.911575 15.675048 -2.787015 8.499191 0.000001 185 C -2.476597 16.236887 17.223460 -0.216516 26.235120 0.42436097E+03 0.99221006E+04 7.684375 6.814240 0.114341 2.024256 0.999104 29.323728 84.223531 0.638421 0.410328 -1.067533 -0.017204 0.067677 0.057165 0.090244 -0.008508 0.029476 -0.004941 -0.015935 0.089783 -0.037217 -0.007122 0.044339 8.436913 5.960986 -1.080445 0.876764 11.305940 -1.332935 8.043814 0.000003 186 C -0.101810 1.242727 16.854500 -0.087000 25.110347 0.36993370E+03 0.83618468E+04 7.497844 6.388463 -0.081409 1.974518 0.999221 27.769604 78.547932 0.654979 0.413714 -1.064819 0.080310 0.008921 0.049117 0.094561 0.010106 0.024506 0.020263 -0.053138 -0.023831 -0.041106 -0.003926 0.045032 8.415716 6.294502 -0.053878 0.526132 11.826346 -1.841707 7.126300 0.000005 187 C 0.755294 3.565307 16.616548 0.480648 31.297293 0.28318679E+03 0.60078441E+04 8.946236 5.789235 0.103438 2.064163 0.999666 23.357558 64.723331 0.650519 0.443814 -1.042727 0.000004 0.018087 -0.008172 0.019848 -0.014733 -0.032596 0.008719 0.037058 -0.024776 -0.028900 -0.019070 0.047971 12.045019 5.693319 2.123264 1.245996 17.504210 -6.232227 12.937528 0.000001 188 C 6.884864 4.607699 9.296177 0.678255 21.070810 0.23439927E+03 0.47996867E+04 7.200794 5.548127 -0.165510 2.024791 0.999148 21.607244 61.140420 0.607410 0.492456 -1.004012 0.001737 -0.001158 -0.065615 0.065649 -0.019465 0.007548 -0.049420 -0.163943 -0.208694 -0.082071 -0.049382 0.131453 8.483597 9.106810 1.060023 0.893437 4.526336 1.228079 11.817646 -0.000001 189 C 0.930110 2.402388 18.795549 -0.083350 25.429256 0.36766445E+03 0.83110164E+04 7.602972 6.387969 -0.044682 1.990115 0.999365 27.697622 78.755500 0.651026 0.416203 -1.061530 0.015622 -0.066077 -0.067976 0.096078 -0.006229 0.025617 0.002673 -0.025886 0.092777 -0.039186 -0.001272 0.040458 8.640880 6.369707 -1.012532 0.784849 10.664134 -2.582559 8.888800 0.000002 190 C 1.673362 1.136859 19.212633 -0.220757 27.565556 0.43310957E+03 0.10213421E+05 8.025581 6.928803 -0.071034 1.961425 0.999120 29.823342 86.993956 0.624860 0.415671 -1.060442 -0.079140 -0.003168 -0.051652 0.094557 0.006184 0.006099 0.010482 -0.059513 -0.013886 -0.029183 -0.006577 0.035760 9.051962 7.542434 -0.719936 1.636279 12.265970 -1.392888 7.347482 0.000003 191 C 0.422947 4.687507 14.710257 0.483061 31.484388 0.28599025E+03 0.60875274E+04 9.016141 5.842746 0.018761 2.037947 0.999818 23.407720 65.153500 0.642839 0.447625 -1.039604 0.008186 -0.003386 0.020379 0.022221 -0.027799 -0.015925 0.003903 0.048456 -0.057036 -0.028824 -0.021317 0.050141 12.051891 7.499955 1.361713 5.773804 9.386685 -1.512305 19.269035 -0.000001 192 C 6.903970 4.873183 10.817467 -0.120119 30.176526 0.45850767E+03 0.10908298E+05 8.544269 7.138079 -0.258052 1.929311 0.997576 28.317067 81.512164 0.617801 0.416723 -1.065523 0.059592 -0.014777 0.076397 0.098011 0.017238 0.009616 -0.016454 -0.006349 -0.072223 -0.035442 0.004953 0.030489 9.959028 7.542534 0.612069 2.470961 7.660270 0.724836 14.674279 -0.000002 193 C -0.185902 5.842282 11.298718 -0.227478 27.713578 0.43360178E+03 0.10245497E+05 8.071310 6.942894 -0.134513 1.936706 0.999267 30.158114 88.553448 0.621789 0.416890 -1.057849 -0.061260 -0.046138 0.046581 0.089729 0.017991 0.014060 0.007761 -0.017378 0.033099 -0.027298 -0.000116 0.027414 9.108813 7.190112 1.347686 0.611516 7.249178 0.467505 12.887150 -0.000004 194 C 7.099432 3.544133 11.547365 -0.218924 26.450573 0.41881974E+03 0.97928240E+04 7.781840 6.795715 -0.038534 1.971833 0.998972 29.687867 86.199004 0.633506 0.413499 -1.061954 -0.007834 0.082532 0.044867 0.094265 0.011151 0.007627 -0.024560 -0.032863 0.021587 -0.030846 -0.004095 0.034941 8.635965 5.777849 0.283029 1.022863 7.679688 0.375842 12.450358 0.000002 195 C 7.056429 3.741211 13.057960 -0.084998 24.903573 0.36254387E+03 0.81690683E+04 7.487225 6.334744 -0.120734 1.961786 0.999216 27.814675 79.040380 0.654885 0.415077 -1.061926 0.057355 0.054119 -0.050022 0.093384 0.032305 0.018553 0.011021 -0.052173 -0.005186 -0.044352 -0.004596 0.048948 8.376354 6.439745 0.812934 1.623884 6.670757 0.605082 12.018560 0.000002 196 C -0.269027 6.039360 12.777230 -0.083725 25.243790 0.36578253E+03 0.82793910E+04 7.596523 6.384159 -0.141954 1.954317 0.999323 28.035029 80.448387 0.647612 0.417845 -1.057730 0.005052 -0.089513 -0.032959 0.095522 0.017753 0.004355 -0.028561 -0.044626 0.021974 -0.037501 -0.006413 0.043914 8.633594 6.042847 0.080228 0.948588 7.159168 -0.677453 12.698768 -0.000006 197 N 6.278800 6.726687 23.217716 -0.106168 36.404544 0.39123314E+03 0.87610776E+04 9.145300 6.289562 0.086157 2.097178 0.998689 24.435013 63.744967 0.721353 0.379172 -1.113977 0.019984 0.080186 -0.043966 0.093606 0.038566 -0.061597 0.041051 -0.153613 0.185982 -0.141064 0.041827 0.099237 11.749308 7.080267 4.823262 -3.162127 17.186364 -3.843205 10.981294 -0.000002 198 N 5.508380 4.599556 22.923618 -0.568260 48.349266 0.60819356E+03 0.15173755E+05 10.703812 7.728458 0.370664 2.084482 0.999744 31.407541 85.853170 0.666622 0.368277 -1.124640 -0.047514 0.005082 0.117018 0.126399 0.038116 0.046437 0.001286 -0.087323 -0.301980 -0.118682 0.008819 0.109863 13.118423 7.394630 5.183496 -0.692250 22.702976 2.204282 9.257663 -0.000000 199 N 5.177044 5.746187 24.958243 -0.562146 48.019557 0.59389802E+03 0.14752051E+05 10.679834 7.662877 0.326749 2.073977 0.999688 31.258881 85.690908 0.665063 0.370769 -1.121011 -0.014581 -0.100390 -0.074209 0.125689 -0.001862 -0.041804 -0.090848 0.100840 0.047317 -0.123238 0.024978 0.098260 13.050265 9.332524 4.079192 -6.456099 11.512409 -4.409566 18.305862 -0.000006 200 N 4.716604 2.421933 22.739138 -0.116371 39.055090 0.41132994E+03 0.93171073E+04 9.608412 6.455367 0.109640 2.103358 0.998569 24.666426 64.489564 0.711758 0.379912 -1.114639 -0.043389 -0.060858 -0.058639 0.094999 0.070202 -0.078532 -0.001589 -0.155465 0.197688 -0.161356 0.051173 0.110182 13.018581 5.663650 1.873816 -0.791622 19.852099 7.456209 13.539993 0.000001 201 N 4.317430 3.542505 24.701575 -0.567732 49.972964 0.61696764E+03 0.15461315E+05 11.002822 7.805840 0.300324 2.061625 0.999563 31.605417 86.832802 0.659954 0.370346 -1.122090 0.064952 0.097774 -0.041978 0.124663 -0.061786 0.008568 0.078797 0.015231 0.169112 -0.116735 0.010192 0.106543 13.860359 6.821066 -0.267807 -3.527584 13.547522 7.998872 21.212489 0.000001 202 N 3.930924 4.754286 26.645297 -0.121225 38.336379 0.41279017E+03 0.93732737E+04 9.517506 6.482957 0.058835 2.081713 0.998517 24.934317 65.608248 0.706474 0.381811 -1.111493 -0.102211 0.031532 0.042449 0.115079 0.083205 -0.084342 0.045013 -0.155035 0.041716 -0.170086 0.062247 0.107839 12.650508 8.153977 1.098616 -6.502879 8.901464 1.634059 20.896082 -0.000002 203 N 2.855396 9.560691 9.849616 -0.106168 36.404546 0.39123316E+03 0.87610783E+04 9.145300 6.289562 0.086157 2.097178 0.998689 24.435014 63.744969 0.721353 0.379172 -1.113977 -0.019984 -0.080186 -0.043966 0.093606 0.038566 0.061597 -0.041051 -0.153613 0.185982 -0.141064 0.041827 0.099237 11.749308 7.080267 4.823262 3.162127 17.186364 3.843205 10.981294 -0.000002 204 N 3.625816 11.687822 9.555518 -0.568260 48.349270 0.60819362E+03 0.15173757E+05 10.703812 7.728459 0.370664 2.084482 0.999744 31.407542 85.853175 0.666622 0.368277 -1.124640 0.047513 -0.005082 0.117018 0.126399 0.038116 -0.046437 -0.001286 -0.087323 -0.301980 -0.118682 0.008819 0.109863 13.118424 7.394630 5.183496 0.692250 22.702977 -2.204282 9.257664 -0.000000 205 N 3.957152 10.541191 11.590143 -0.562146 48.019559 0.59389805E+03 0.14752052E+05 10.679835 7.662877 0.326749 2.073977 0.999688 31.258881 85.690910 0.665063 0.370769 -1.121011 0.014581 0.100390 -0.074209 0.125689 -0.001862 0.041804 0.090848 0.100840 0.047317 -0.123238 0.024978 0.098260 13.050266 9.332525 4.079193 6.456100 11.512410 4.409567 18.305863 -0.000006 206 N 4.417592 13.865445 9.371038 -0.116371 39.055089 0.41132991E+03 0.93171067E+04 9.608412 6.455367 0.109640 2.103358 0.998569 24.666425 64.489562 0.711758 0.379912 -1.114639 0.043389 0.060858 -0.058639 0.094999 0.070202 0.078532 0.001589 -0.155465 0.197688 -0.161355 0.051173 0.110182 13.018581 5.663651 1.873816 0.791622 19.852099 -7.456209 13.539993 0.000001 207 N 4.816766 12.744873 11.333475 -0.567732 49.972977 0.61696782E+03 0.15461320E+05 11.002824 7.805842 0.300324 2.061625 0.999563 31.605420 86.832817 0.659954 0.370347 -1.122090 -0.064952 -0.097774 -0.041978 0.124663 -0.061786 -0.008568 -0.078798 0.015231 0.169112 -0.116735 0.010192 0.106543 13.860362 6.821067 -0.267807 3.527585 13.547525 -7.998874 21.212495 0.000001 208 N 5.203272 11.533092 13.277197 -0.121225 38.336380 0.41279018E+03 0.93732739E+04 9.517506 6.482957 0.058835 2.081713 0.998517 24.934317 65.608249 0.706474 0.381811 -1.111493 0.102211 -0.031532 0.042449 0.115079 0.083205 0.084342 -0.045013 -0.155035 0.041716 -0.170086 0.062247 0.107839 12.650508 8.153978 1.098617 6.502880 8.901464 -1.634059 20.896083 -0.000002 209 N -1.238654 9.560691 3.518484 -0.106168 36.404546 0.39123317E+03 0.87610784E+04 9.145300 6.289562 0.086157 2.097178 0.998689 24.435014 63.744970 0.721353 0.379172 -1.113977 -0.019984 -0.080186 0.043966 0.093606 0.038566 -0.061597 0.041051 -0.153613 0.185982 -0.141064 0.041827 0.099237 11.749309 7.080267 4.823262 -3.162127 17.186365 -3.843205 10.981294 -0.000002 210 N -0.468234 11.687822 3.812582 -0.568260 48.349271 0.60819362E+03 0.15173757E+05 10.703813 7.728459 0.370664 2.084482 0.999744 31.407542 85.853176 0.666622 0.368278 -1.124640 0.047513 -0.005082 -0.117018 0.126399 0.038116 0.046437 0.001286 -0.087323 -0.301980 -0.118682 0.008819 0.109863 13.118424 7.394631 5.183497 -0.692250 22.702979 2.204282 9.257664 -0.000000 211 N -0.136898 10.541191 1.777957 -0.562146 48.019554 0.59389799E+03 0.14752050E+05 10.679833 7.662876 0.326749 2.073977 0.999688 31.258880 85.690904 0.665063 0.370769 -1.121011 0.014581 0.100390 0.074209 0.125689 -0.001862 -0.041804 -0.090848 0.100840 0.047317 -0.123238 0.024978 0.098260 13.050264 9.332524 4.079192 -6.456099 11.512409 -4.409566 18.305860 -0.000006 212 N 0.323542 13.865445 3.997062 -0.116371 39.055093 0.41132995E+03 0.93171079E+04 9.608413 6.455367 0.109640 2.103358 0.998569 24.666426 64.489568 0.711758 0.379912 -1.114639 0.043389 0.060858 0.058639 0.094999 0.070202 -0.078532 -0.001589 -0.155465 0.197688 -0.161355 0.051173 0.110182 13.018583 5.663651 1.873816 -0.791622 19.852102 7.456210 13.539995 0.000001 213 N 0.722716 12.744873 2.034625 -0.567732 49.972982 0.61696788E+03 0.15461322E+05 11.002826 7.805843 0.300324 2.061625 0.999563 31.605420 86.832822 0.659954 0.370347 -1.122090 -0.064952 -0.097774 0.041978 0.124663 -0.061786 0.008568 0.078797 0.015231 0.169112 -0.116735 0.010192 0.106543 13.860364 6.821068 -0.267807 -3.527586 13.547527 7.998876 21.212497 0.000001 214 N 1.109222 11.533092 0.090903 -0.121225 38.336375 0.41279012E+03 0.93732723E+04 9.517506 6.482957 0.058835 2.081713 0.998517 24.934315 65.608243 0.706474 0.381811 -1.111493 0.102211 -0.031532 -0.042449 0.115079 0.083205 -0.084342 0.045013 -0.155035 0.041716 -0.170086 0.062247 0.107839 12.650507 8.153977 1.098616 -6.502879 8.901464 1.634060 20.896081 -0.000001 215 N 2.184750 6.726687 16.886584 -0.106168 36.404544 0.39123314E+03 0.87610777E+04 9.145300 6.289562 0.086157 2.097178 0.998689 24.435013 63.744968 0.721353 0.379172 -1.113977 0.019984 0.080186 0.043966 0.093606 0.038566 0.061597 -0.041051 -0.153613 0.185982 -0.141064 0.041827 0.099237 11.749308 7.080267 4.823262 3.162127 17.186364 3.843204 10.981294 -0.000002 216 N 1.414330 4.599556 17.180682 -0.568260 48.349264 0.60819354E+03 0.15173755E+05 10.703812 7.728458 0.370664 2.084482 0.999744 31.407540 85.853168 0.666622 0.368278 -1.124640 -0.047513 0.005082 -0.117018 0.126399 0.038116 -0.046437 -0.001286 -0.087323 -0.301980 -0.118682 0.008819 0.109863 13.118423 7.394630 5.183496 0.692250 22.702976 -2.204282 9.257663 -0.000000 217 N 1.082994 5.746187 15.146057 -0.562146 48.019550 0.59389793E+03 0.14752048E+05 10.679833 7.662876 0.326749 2.073977 0.999688 31.258879 85.690899 0.665063 0.370769 -1.121011 -0.014581 -0.100390 0.074209 0.125689 -0.001862 0.041804 0.090848 0.100840 0.047317 -0.123238 0.024978 0.098260 13.050263 9.332523 4.079192 6.456098 11.512408 4.409566 18.305859 -0.000006 218 N 0.622554 2.421933 17.365162 -0.116371 39.055088 0.41132991E+03 0.93171066E+04 9.608412 6.455367 0.109640 2.103358 0.998569 24.666425 64.489561 0.711758 0.379912 -1.114639 -0.043389 -0.060858 0.058639 0.094999 0.070202 0.078532 0.001589 -0.155465 0.197688 -0.161355 0.051173 0.110182 13.018580 5.663650 1.873816 0.791622 19.852098 -7.456208 13.539992 0.000001 219 N 0.223380 3.542505 15.402725 -0.567732 49.972960 0.61696760E+03 0.15461313E+05 11.002821 7.805840 0.300325 2.061625 0.999563 31.605416 86.832797 0.659954 0.370346 -1.122090 0.064952 0.097774 0.041978 0.124663 -0.061786 -0.008568 -0.078797 0.015231 0.169112 -0.116735 0.010192 0.106543 13.860358 6.821066 -0.267806 3.527584 13.547521 -7.998871 21.212487 0.000001 220 N -0.163126 4.754286 13.459003 -0.121225 38.336375 0.41279014E+03 0.93732727E+04 9.517505 6.482957 0.058835 2.081713 0.998517 24.934316 65.608243 0.706474 0.381811 -1.111493 -0.102211 0.031532 -0.042449 0.115079 0.083205 0.084342 -0.045013 -0.155035 0.041716 -0.170086 0.062247 0.107839 12.650506 8.153976 1.098616 6.502878 8.901464 -1.634059 20.896079 -0.000001 221 O 4.429632 10.083516 20.453193 -0.579097 36.035531 0.57232945E+03 0.13924982E+05 8.623346 7.386359 0.538822 2.232525 0.994988 27.538890 71.971306 0.704225 0.357475 -1.144326 0.003898 -0.047495 0.004639 0.047880 0.004420 -0.002369 0.046196 0.159174 0.135644 -0.115614 0.056547 0.059067 9.759165 14.151860 -0.170677 4.053767 7.088056 -0.234291 8.037580 -0.000003 222 O -2.114060 11.476087 20.974549 -0.784895 48.782836 0.80370447E+03 0.21445065E+05 10.745665 8.888930 -0.147347 1.943449 0.996612 32.491368 91.104469 0.622646 0.368667 -1.127153 -0.031741 -0.061955 0.053896 0.088038 0.020027 -0.051074 0.026555 -0.110577 0.019966 -0.092998 0.028657 0.064341 12.504156 13.097937 3.730892 -0.880465 16.465719 -2.967585 7.948814 -0.000001 223 O 3.772761 14.816628 21.060105 -0.622914 32.861112 0.51667180E+03 0.12292403E+05 8.077790 6.987450 0.644432 2.244476 0.997822 28.189427 73.611873 0.726491 0.354368 -1.143185 -0.002007 0.037045 0.034906 0.050939 -0.008869 -0.012322 -0.059933 0.151917 0.049765 -0.113125 0.042399 0.070726 8.924430 13.625943 -1.420456 -1.405660 7.794037 0.386808 5.353312 0.000004 224 O 3.891368 4.742884 4.692203 -0.708201 43.389832 0.70584335E+03 0.18147898E+05 9.773238 8.242334 0.286380 2.097261 0.997134 30.394646 82.399992 0.660032 0.360930 -1.138417 -0.063057 0.069265 -0.040869 0.102197 0.000826 0.042934 0.032132 -0.045576 -0.136982 -0.077560 0.017619 0.059941 11.110605 13.650029 1.009225 5.297665 6.656040 -0.276836 13.025747 -0.000001 225 O 1.871476 13.935481 20.487950 -0.780542 53.011786 0.79516368E+03 0.21099653E+05 11.240288 8.762069 0.088009 2.012017 0.998883 32.067578 88.826247 0.637528 0.362066 -1.135525 0.020830 0.077413 0.011739 0.081022 0.040375 0.027543 -0.017725 -0.084845 0.247607 -0.105345 0.016776 0.088569 13.664258 13.194952 4.887370 2.578892 19.635178 4.043720 8.162645 0.000003 226 O 1.711655 4.234718 4.566543 -0.648473 38.534914 0.60199717E+03 0.14907754E+05 9.113739 7.648207 0.266193 2.114660 0.996644 29.072507 77.921600 0.678785 0.364381 -1.133157 0.022045 0.011982 -0.050573 0.056456 -0.009374 -0.040716 0.018666 -0.042717 -0.227293 -0.092495 0.025295 0.067200 10.463630 13.700767 1.054463 -5.359225 6.925906 -1.615948 10.764218 -0.000000 227 O 4.704564 6.203862 7.085093 -0.579097 36.035534 0.57232950E+03 0.13924984E+05 8.623346 7.386359 0.538822 2.232525 0.994988 27.538891 71.971310 0.704225 0.357475 -1.144326 -0.003898 0.047495 0.004639 0.047880 0.004421 0.002369 -0.046196 0.159174 0.135644 -0.115614 0.056547 0.059067 9.759166 14.151861 -0.170677 -4.053768 7.088056 0.234291 8.037580 -0.000003 228 O 3.060156 4.811291 7.606449 -0.784895 48.782836 0.80370447E+03 0.21445065E+05 10.745665 8.888930 -0.147347 1.943449 0.996612 32.491369 91.104470 0.622646 0.368667 -1.127153 0.031741 0.061955 0.053896 0.088038 0.020027 0.051074 -0.026555 -0.110577 0.019966 -0.092998 0.028657 0.064341 12.504156 13.097936 3.730892 0.880465 16.465718 2.967585 7.948813 -0.000001 229 O 5.361435 1.470750 7.692005 -0.622914 32.861119 0.51667193E+03 0.12292407E+05 8.077791 6.987451 0.644432 2.244476 0.997822 28.189430 73.611883 0.726491 0.354368 -1.143185 0.002007 -0.037045 0.034906 0.050939 -0.008869 0.012322 0.059933 0.151917 0.049765 -0.113125 0.042399 0.070726 8.924432 13.625944 -1.420456 1.405661 7.794038 -0.386808 5.353312 0.000004 230 O 5.242828 11.544494 18.060303 -0.708201 43.389828 0.70584326E+03 0.18147895E+05 9.773237 8.242333 0.286380 2.097261 0.997134 30.394645 82.399986 0.660032 0.360930 -1.138417 0.063057 -0.069265 -0.040869 0.102197 0.000826 -0.042934 -0.032132 -0.045576 -0.136982 -0.077560 0.017619 0.059941 11.110604 13.650028 1.009225 -5.297665 6.656039 0.276836 13.025746 -0.000001 231 O 7.262720 2.351897 7.119850 -0.780542 53.011786 0.79516367E+03 0.21099653E+05 11.240288 8.762069 0.088009 2.012017 0.998883 32.067578 88.826247 0.637528 0.362066 -1.135525 -0.020830 -0.077413 0.011739 0.081022 0.040375 -0.027543 0.017725 -0.084845 0.247607 -0.105345 0.016776 0.088569 13.664258 13.194951 4.887370 -2.578892 19.635178 -4.043720 8.162645 0.000003 232 O -0.765559 12.052660 17.934643 -0.648473 38.534912 0.60199714E+03 0.14907753E+05 9.113739 7.648207 0.266193 2.114660 0.996644 29.072506 77.921597 0.678785 0.364381 -1.133157 -0.022045 -0.011982 -0.050573 0.056456 -0.009374 0.040716 -0.018666 -0.042717 -0.227293 -0.092495 0.025295 0.067200 10.463630 13.700766 1.054463 5.359225 6.925905 1.615948 10.764218 -0.000000 233 O 0.610514 6.203862 6.283007 -0.579097 36.035532 0.57232947E+03 0.13924983E+05 8.623346 7.386359 0.538822 2.232525 0.994988 27.538890 71.971308 0.704225 0.357475 -1.144326 -0.003898 0.047495 -0.004639 0.047880 0.004420 -0.002369 0.046196 0.159174 0.135644 -0.115614 0.056547 0.059067 9.759165 14.151860 -0.170677 4.053767 7.088056 -0.234291 8.037580 -0.000003 234 O 7.154206 4.811291 5.761651 -0.784895 48.782838 0.80370455E+03 0.21445068E+05 10.745666 8.888930 -0.147347 1.943449 0.996612 32.491370 91.104477 0.622646 0.368667 -1.127153 0.031742 0.061955 -0.053896 0.088038 0.020027 -0.051074 0.026555 -0.110577 0.019966 -0.092998 0.028657 0.064341 12.504157 13.097937 3.730892 -0.880465 16.465719 -2.967585 7.948814 -0.000001 235 O 1.267385 1.470750 5.676095 -0.622914 32.861113 0.51667183E+03 0.12292404E+05 8.077790 6.987450 0.644432 2.244476 0.997822 28.189428 73.611875 0.726491 0.354368 -1.143185 0.002007 -0.037045 -0.034906 0.050939 -0.008869 -0.012322 -0.059933 0.151917 0.049765 -0.113125 0.042399 0.070726 8.924430 13.625942 -1.420456 -1.405661 7.794037 0.386808 5.353312 0.000004 236 O 1.148778 11.544494 22.043997 -0.708201 43.389823 0.70584314E+03 0.18147891E+05 9.773236 8.242333 0.286380 2.097261 0.997134 30.394642 82.399975 0.660032 0.360930 -1.138417 0.063057 -0.069265 0.040869 0.102197 0.000826 0.042934 0.032132 -0.045576 -0.136982 -0.077560 0.017619 0.059941 11.110603 13.650027 1.009224 5.297665 6.656039 -0.276836 13.025745 -0.000001 237 O 3.168670 2.351897 6.248250 -0.780542 53.011792 0.79516382E+03 0.21099657E+05 11.240289 8.762070 0.088009 2.012016 0.998883 32.067580 88.826254 0.637528 0.362066 -1.135525 -0.020830 -0.077413 -0.011739 0.081022 0.040375 0.027543 -0.017725 -0.084845 0.247607 -0.105345 0.016776 0.088569 13.664259 13.194952 4.887369 2.578891 19.635180 4.043721 8.162646 0.000003 238 O 3.328491 12.052660 22.169657 -0.648473 38.534918 0.60199727E+03 0.14907757E+05 9.113740 7.648208 0.266192 2.114660 0.996644 29.072508 77.921606 0.678785 0.364381 -1.133157 -0.022045 -0.011982 0.050573 0.056456 -0.009374 -0.040716 0.018666 -0.042717 -0.227293 -0.092495 0.025295 0.067200 10.463631 13.700768 1.054463 -5.359225 6.925906 -1.615948 10.764219 -0.000000 239 O 0.335582 10.083516 19.651107 -0.579097 36.035531 0.57232947E+03 0.13924983E+05 8.623346 7.386359 0.538822 2.232525 0.994988 27.538890 71.971308 0.704225 0.357475 -1.144326 0.003898 -0.047495 -0.004639 0.047880 0.004420 0.002369 -0.046196 0.159174 0.135644 -0.115614 0.056547 0.059067 9.759165 14.151860 -0.170677 -4.053767 7.088056 0.234291 8.037580 -0.000003 240 O 1.979990 11.476087 19.129751 -0.784895 48.782834 0.80370446E+03 0.21445065E+05 10.745665 8.888930 -0.147347 1.943449 0.996612 32.491369 91.104471 0.622646 0.368667 -1.127153 -0.031742 -0.061955 -0.053896 0.088038 0.020027 0.051074 -0.026555 -0.110577 0.019966 -0.092998 0.028657 0.064341 12.504155 13.097935 3.730891 0.880465 16.465718 2.967585 7.948813 -0.000001 241 O -0.321289 14.816628 19.044195 -0.622914 32.861117 0.51667190E+03 0.12292406E+05 8.077791 6.987451 0.644432 2.244476 0.997822 28.189429 73.611881 0.726491 0.354368 -1.143185 -0.002007 0.037045 -0.034906 0.050939 -0.008869 0.012322 0.059933 0.151917 0.049765 -0.113125 0.042399 0.070726 8.924431 13.625944 -1.420456 1.405661 7.794038 -0.386808 5.353312 0.000004 242 O -0.202682 4.742884 8.675897 -0.708201 43.389825 0.70584318E+03 0.18147892E+05 9.773236 8.242333 0.286380 2.097261 0.997134 30.394643 82.399978 0.660032 0.360930 -1.138417 -0.063057 0.069265 0.040869 0.102197 0.000826 -0.042934 -0.032132 -0.045576 -0.136982 -0.077560 0.017619 0.059941 11.110604 13.650027 1.009224 -5.297665 6.656039 0.276836 13.025745 -0.000001 243 O -2.222574 13.935481 19.616350 -0.780542 53.011793 0.79516382E+03 0.21099657E+05 11.240289 8.762070 0.088009 2.012016 0.998883 32.067580 88.826254 0.637528 0.362066 -1.135525 0.020830 0.077413 -0.011739 0.081022 0.040375 -0.027543 0.017725 -0.084845 0.247607 -0.105345 0.016776 0.088569 13.664259 13.194952 4.887370 -2.578891 19.635180 -4.043721 8.162646 0.000003 244 O 5.805705 4.234718 8.801557 -0.648473 38.534918 0.60199726E+03 0.14907757E+05 9.113740 7.648208 0.266192 2.114660 0.996644 29.072508 77.921606 0.678785 0.364381 -1.133157 0.022045 0.011982 0.050573 0.056456 -0.009374 0.040716 -0.018666 -0.042717 -0.227293 -0.092495 0.025295 0.067200 10.463631 13.700768 1.054463 5.359225 6.925906 1.615948 10.764219 -0.000000 ****************************************************** Auxiliary information for the entire system The total spin magnetic moment of the unit cell is 0.000008 The total net atomic charge of the unit cell is 0.000014 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= 109496 The rms potential error without charges in kcal/mol is= 3.83186 The rms potential error with partial charges in kcal/mol is= 1.46359 The RRMSE value at monopole order= 0.38195 The rms potential error with partial charges and cloud penetration in kcal/mol is= 1.44803 The RRMSE value at monopole order with cloud penetration is= 0.37789 The rms potential error with partial charges and atomic dipoles in kcal/mol is= 0.49434 The RRMSE value at dipole order= 0.12901 The rms potential error with partial charges, atomic dipoles and cloud penetration in kcal/mol is= 0.49185 The RRMSE value at dipole order with cloud penetration= 0.12836 ****************************************************** 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.