N E dE d eps ncg rms rms(c) DAV: 1 0.617485726502E+04 0.61749E+04 -0.50213E+05 1506 0.116E+03 DAV: 2 -0.113560195700E+04 -0.73105E+04 -0.69410E+04 1900 0.284E+02 DAV: 3 -0.186848272060E+04 -0.73288E+03 -0.71151E+03 1740 0.936E+01 DAV: 4 -0.189059033595E+04 -0.22108E+02 -0.21974E+02 1860 0.161E+01 DAV: 5 -0.189113576931E+04 -0.54543E+00 -0.54418E+00 1796 0.251E+00 0.999E+01 DAV: 6 -0.177541792516E+04 0.11572E+03 -0.10985E+03 1652 0.404E+01 0.950E+01 DAV: 7 -0.170373852057E+04 0.71679E+02 -0.20654E+02 2036 0.279E+01 0.659E+01 DAV: 8 -0.167453117590E+04 0.29207E+02 -0.12310E+02 2052 0.201E+01 0.516E+01 DAV: 9 -0.165328480461E+04 0.21246E+02 -0.71471E+01 2036 0.146E+01 0.449E+01 DAV: 10 -0.165245581029E+04 0.82899E+00 -0.41081E+01 1844 0.972E+00 0.423E+01 DAV: 11 -0.164389978683E+04 0.85560E+01 -0.31244E+01 2012 0.798E+00 0.371E+01 DAV: 12 -0.163999347768E+04 0.39063E+01 -0.14626E+01 1876 0.516E+00 0.223E+01 DAV: 13 -0.163797121786E+04 0.20223E+01 -0.11292E+01 2100 0.502E+00 0.277E+01 DAV: 14 -0.163684798696E+04 0.11232E+01 -0.10380E+01 2036 0.419E+00 0.231E+01 DAV: 15 -0.163545771558E+04 0.13903E+01 -0.64239E+00 2076 0.347E+00 0.225E+01 DAV: 16 -0.163444743016E+04 0.10103E+01 -0.61357E+00 2084 0.272E+00 0.160E+01 DAV: 17 -0.163359062328E+04 0.85681E+00 -0.31442E+00 2028 0.223E+00 0.179E+01 DAV: 18 -0.163316624068E+04 0.42438E+00 -0.21535E+00 1892 0.141E+00 0.112E+01 DAV: 19 -0.163396401693E+04 -0.79778E+00 -0.21220E+00 2004 0.146E+00 0.245E+01 DAV: 20 -0.163289962131E+04 0.10644E+01 -0.10187E+00 1916 0.102E+00 0.929E+00 DAV: 21 -0.163281440264E+04 0.85219E-01 -0.86598E-01 1980 0.826E-01 0.918E+00 DAV: 22 -0.163279595025E+04 0.18452E-01 -0.71165E-01 1908 0.545E-01 0.752E+00 DAV: 23 -0.163272829841E+04 0.67652E-01 -0.34941E-01 2060 0.489E-01 0.401E+00 DAV: 24 -0.163277281289E+04 -0.44514E-01 -0.30643E-01 2076 0.497E-01 0.534E+00 DAV: 25 -0.163278462877E+04 -0.11816E-01 -0.39850E-01 2140 0.475E-01 0.589E+00 DAV: 26 -0.163270451956E+04 0.80109E-01 -0.22227E-01 2004 0.389E-01 0.205E+00 DAV: 27 -0.163271101740E+04 -0.64978E-02 -0.77740E-02 1884 0.248E-01 0.153E+00 DAV: 28 -0.163270929182E+04 0.17256E-02 -0.35968E-02 1964 0.196E-01 0.116E+00 DAV: 29 -0.163271108212E+04 -0.17903E-02 -0.16238E-02 1988 0.145E-01 0.103E+00 DAV: 30 -0.163270876992E+04 0.23122E-02 -0.12001E-02 1996 0.102E-01 0.642E-01 DAV: 31 -0.163270887481E+04 -0.10489E-03 -0.83033E-03 2068 0.818E-02 0.575E-01 DAV: 32 -0.163270871595E+04 0.15886E-03 -0.41375E-03 1940 0.677E-02 0.323E-01 DAV: 33 -0.163270884687E+04 -0.13092E-03 -0.18227E-03 1940 0.528E-02 0.261E-01 DAV: 34 -0.163270875079E+04 0.96081E-04 -0.11405E-03 1956 0.371E-02 0.188E-01 DAV: 35 -0.163270881444E+04 -0.63643E-04 -0.49239E-04 1908 0.264E-02 0.181E-01 DAV: 36 -0.163270878954E+04 0.24895E-04 -0.27816E-04 1876 0.200E-02 0.147E-01 DAV: 37 -0.163270877997E+04 0.95667E-05 -0.17561E-04 1508 0.150E-02 0.854E-02 DAV: 38 -0.163270878737E+04 -0.73981E-05 -0.10336E-04 1404 0.126E-02 0.746E-02 DAV: 39 -0.163270878805E+04 -0.67465E-06 -0.85546E-05 1108 0.951E-03 1 T= 343. E= -.16185060E+04 F= -.16327088E+04 E0= -.16325841E+04 EK= 0.14202E+02 SP= 0.00E+00 SK= 0.88E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.164798626714E+04 -0.15277E+02 -0.41322E+02 1506 0.269E+01 0.992E+00 DAV: 2 -0.165929324194E+04 -0.11307E+02 -0.23386E+01 1996 0.702E+00 0.371E+01 DAV: 3 -0.165022405436E+04 0.90692E+01 -0.10026E+01 2060 0.426E+00 0.212E+01 DAV: 4 -0.165038972125E+04 -0.16567E+00 -0.89242E+00 1972 0.225E+00 0.243E+01 DAV: 5 -0.164948825724E+04 0.90146E+00 -0.25758E+00 1884 0.142E+00 0.166E+01 DAV: 6 -0.164811569737E+04 0.13726E+01 -0.19298E+00 1916 0.138E+00 0.856E+00 DAV: 7 -0.164832780209E+04 -0.21210E+00 -0.21625E+00 2060 0.138E+00 0.110E+01 DAV: 8 -0.164811001195E+04 0.21779E+00 -0.16173E+00 1948 0.106E+00 0.789E+00 DAV: 9 -0.164802403600E+04 0.85976E-01 -0.87186E-01 2132 0.918E-01 0.652E+00 DAV: 10 -0.164819783749E+04 -0.17380E+00 -0.10188E+00 1964 0.740E-01 0.139E+01 DAV: 11 -0.164800291399E+04 0.19492E+00 -0.82069E-01 1908 0.622E-01 0.713E+00 DAV: 12 -0.164804806172E+04 -0.45148E-01 -0.76120E-01 1956 0.650E-01 0.865E+00 DAV: 13 -0.164796150402E+04 0.86558E-01 -0.71376E-01 1964 0.558E-01 0.577E+00 DAV: 14 -0.164787791972E+04 0.83584E-01 -0.35735E-01 1964 0.479E-01 0.239E+00 DAV: 15 -0.164788750494E+04 -0.95852E-02 -0.11656E-01 1900 0.343E-01 0.194E+00 DAV: 16 -0.164788047083E+04 0.70341E-02 -0.46595E-02 1900 0.248E-01 0.149E+00 DAV: 17 -0.164787495950E+04 0.55113E-02 -0.26100E-02 2044 0.175E-01 0.981E-01 DAV: 18 -0.164787832937E+04 -0.33699E-02 -0.18368E-02 2020 0.146E-01 0.122E+00 DAV: 19 -0.164787428654E+04 0.40428E-02 -0.15423E-02 2116 0.130E-01 0.754E-01 DAV: 20 -0.164787412335E+04 0.16319E-03 -0.62908E-03 1980 0.943E-02 0.481E-01 DAV: 21 -0.164787371090E+04 0.41245E-03 -0.31040E-03 2076 0.627E-02 0.344E-01 DAV: 22 -0.164787351512E+04 0.19578E-03 -0.13953E-03 1932 0.414E-02 0.235E-01 DAV: 23 -0.164787354959E+04 -0.34469E-04 -0.86223E-04 1956 0.294E-02 0.211E-01 DAV: 24 -0.164787345976E+04 0.89832E-04 -0.52445E-04 1844 0.219E-02 0.111E-01 DAV: 25 -0.164787346454E+04 -0.47737E-05 -0.23721E-04 1596 0.163E-02 0.726E-02 DAV: 26 -0.164787347228E+04 -0.77440E-05 -0.14789E-04 1356 0.126E-02 0.688E-02 DAV: 27 -0.164787345534E+04 0.16936E-04 -0.55732E-05 940 0.923E-03 0.392E-02 DAV: 28 -0.164787345833E+04 -0.29824E-05 -0.23655E-05 788 0.615E-03 2 T= 695. E= -.16189638E+04 F= -.16478735E+04 E0= -.16477555E+04 EK= 0.28760E+02 SP= 0.46E-01 SK= 0.10E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.167029532550E+04 -0.22422E+02 -0.20541E+02 1522 0.208E+01 0.828E+00 DAV: 2 -0.167838539527E+04 -0.80901E+01 -0.23021E+01 1820 0.630E+00 0.333E+01 DAV: 3 -0.167296845294E+04 0.54169E+01 -0.10143E+01 2028 0.357E+00 0.259E+01 DAV: 4 -0.167242244486E+04 0.54601E+00 -0.57607E+00 1780 0.158E+00 0.162E+01 DAV: 5 -0.167137127872E+04 0.10512E+01 -0.19427E+00 2004 0.173E+00 0.162E+01 DAV: 6 -0.167147386763E+04 -0.10259E+00 -0.33713E+00 1788 0.111E+00 0.133E+01 DAV: 7 -0.167129555988E+04 0.17831E+00 -0.24885E+00 1972 0.111E+00 0.124E+01 DAV: 8 -0.167101514599E+04 0.28041E+00 -0.16462E+00 1956 0.104E+00 0.929E+00 DAV: 9 -0.167093050827E+04 0.84638E-01 -0.10502E+00 1908 0.767E-01 0.885E+00 DAV: 10 -0.167088066670E+04 0.49842E-01 -0.96924E-01 2012 0.692E-01 0.692E+00 DAV: 11 -0.167078622842E+04 0.94438E-01 -0.49578E-01 2012 0.637E-01 0.527E+00 DAV: 12 -0.167079968650E+04 -0.13458E-01 -0.40987E-01 1948 0.561E-01 0.471E+00 DAV: 13 -0.167087262908E+04 -0.72943E-01 -0.57027E-01 1956 0.532E-01 0.757E+00 DAV: 14 -0.167076938785E+04 0.10324E+00 -0.48596E-01 2140 0.489E-01 0.510E+00 DAV: 15 -0.167074508732E+04 0.24301E-01 -0.16767E-01 1972 0.361E-01 0.276E+00 DAV: 16 -0.167073749718E+04 0.75901E-02 -0.66147E-02 1868 0.231E-01 0.142E+00 DAV: 17 -0.167073734413E+04 0.15304E-03 -0.23596E-02 1900 0.154E-01 0.942E-01 DAV: 18 -0.167073659088E+04 0.75326E-03 -0.11892E-02 1956 0.103E-01 0.631E-01 DAV: 19 -0.167073722146E+04 -0.63058E-03 -0.59386E-03 1908 0.837E-02 0.651E-01 DAV: 20 -0.167073673671E+04 0.48475E-03 -0.36503E-03 2076 0.726E-02 0.538E-01 DAV: 21 -0.167073641384E+04 0.32287E-03 -0.29478E-03 2068 0.592E-02 0.361E-01 DAV: 22 -0.167073616548E+04 0.24837E-03 -0.20093E-03 1932 0.416E-02 0.209E-01 DAV: 23 -0.167073611169E+04 0.53788E-04 -0.90258E-04 1924 0.291E-02 0.166E-01 DAV: 24 -0.167073609741E+04 0.14276E-04 -0.35333E-04 1876 0.202E-02 0.144E-01 DAV: 25 -0.167073607505E+04 0.22364E-04 -0.14486E-04 1460 0.145E-02 0.995E-02 DAV: 26 -0.167073606793E+04 0.71226E-05 -0.83548E-05 1132 0.109E-02 3 T= 1181. E= -.16200046E+04 F= -.16707361E+04 E0= -.16706258E+04 EK= 0.48863E+02 SP= 0.50E+00 SK= 0.14E+01 N E dE d eps ncg rms rms(c) DAV: 1 -0.169085953767E+04 -0.20123E+02 -0.80229E+01 1586 0.170E+01 0.525E+00 DAV: 2 -0.169495996485E+04 -0.41004E+01 -0.18825E+01 1724 0.510E+00 0.218E+01 DAV: 3 -0.169231042107E+04 0.26495E+01 -0.44483E+00 2028 0.216E+00 0.130E+01 DAV: 4 -0.169262898923E+04 -0.31857E+00 -0.34239E+00 1916 0.116E+00 0.135E+01 DAV: 5 -0.169235971271E+04 0.26928E+00 -0.16850E+00 1988 0.106E+00 0.158E+01 DAV: 6 -0.169220316347E+04 0.15655E+00 -0.21213E+00 1900 0.703E-01 0.121E+01 DAV: 7 -0.169207098927E+04 0.13217E+00 -0.13120E+00 1972 0.628E-01 0.767E+00 DAV: 8 -0.169193690218E+04 0.13409E+00 -0.41839E-01 1892 0.534E-01 0.505E+00 DAV: 9 -0.169201518211E+04 -0.78280E-01 -0.67566E-01 1908 0.546E-01 0.692E+00 DAV: 10 -0.169194341183E+04 0.71770E-01 -0.66462E-01 1956 0.491E-01 0.570E+00 DAV: 11 -0.169195029422E+04 -0.68824E-02 -0.31309E-01 2028 0.458E-01 0.485E+00 DAV: 12 -0.169190548024E+04 0.44814E-01 -0.35170E-01 1908 0.400E-01 0.343E+00 DAV: 13 -0.169190996213E+04 -0.44819E-02 -0.15489E-01 1988 0.378E-01 0.292E+00 DAV: 14 -0.169189567889E+04 0.14283E-01 -0.81731E-02 1916 0.247E-01 0.215E+00 DAV: 15 -0.169189009466E+04 0.55842E-02 -0.43699E-02 1956 0.184E-01 0.142E+00 DAV: 16 -0.169188836226E+04 0.17324E-02 -0.17045E-02 1932 0.131E-01 0.899E-01 DAV: 17 -0.169188879073E+04 -0.42846E-03 -0.16279E-02 1932 0.977E-02 0.800E-01 DAV: 18 -0.169188806928E+04 0.72144E-03 -0.84833E-03 1908 0.752E-02 0.416E-01 DAV: 19 -0.169188841063E+04 -0.34134E-03 -0.31777E-03 2036 0.549E-02 0.411E-01 DAV: 20 -0.169188796248E+04 0.44815E-03 -0.17514E-03 1940 0.388E-02 0.187E-01 DAV: 21 -0.169188805391E+04 -0.91431E-04 -0.69397E-04 1908 0.297E-02 0.184E-01 DAV: 22 -0.169188799426E+04 0.59645E-04 -0.52376E-04 1900 0.237E-02 0.139E-01 DAV: 23 -0.169188795739E+04 0.36877E-04 -0.25201E-04 1732 0.181E-02 0.861E-02 DAV: 24 -0.169188794008E+04 0.17306E-04 -0.11499E-04 1356 0.125E-02 0.485E-02 DAV: 25 -0.169188793727E+04 0.28149E-05 -0.36577E-05 916 0.813E-03 4 T= 1516. E= -.16206873E+04 F= -.16918879E+04 E0= -.16917724E+04 EK= 0.62707E+02 SP= 0.18E+01 SK= 0.67E+01 N E dE d eps ncg rms rms(c) DAV: 1 -0.170651614151E+04 -0.14628E+02 -0.82577E+01 1562 0.176E+01 0.481E+00 DAV: 2 -0.170979447342E+04 -0.32783E+01 -0.17789E+01 1684 0.504E+00 0.209E+01 DAV: 3 -0.170827923499E+04 0.15152E+01 -0.58955E+00 1988 0.174E+00 0.178E+01 DAV: 4 -0.170842378823E+04 -0.14455E+00 -0.29625E+00 1764 0.794E-01 0.133E+01 DAV: 5 -0.170791283385E+04 0.51095E+00 -0.11007E+00 2020 0.100E+00 0.901E+00 DAV: 6 -0.170786336302E+04 0.49471E-01 -0.13207E+00 1948 0.804E-01 0.968E+00 DAV: 7 -0.170787636958E+04 -0.13007E-01 -0.22528E+00 1812 0.544E-01 0.845E+00 DAV: 8 -0.170767843310E+04 0.19794E+00 -0.33302E-01 1916 0.473E-01 0.415E+00 DAV: 9 -0.170775129404E+04 -0.72861E-01 -0.42755E-01 1892 0.415E-01 0.578E+00 DAV: 10 -0.170770260154E+04 0.48693E-01 -0.39364E-01 1932 0.424E-01 0.406E+00 DAV: 11 -0.170775511213E+04 -0.52511E-01 -0.43266E-01 1916 0.401E-01 0.619E+00 DAV: 12 -0.170770082114E+04 0.54291E-01 -0.32555E-01 1836 0.363E-01 0.401E+00 DAV: 13 -0.170771234423E+04 -0.11523E-01 -0.35552E-01 1988 0.361E-01 0.422E+00 DAV: 14 -0.170769339248E+04 0.18952E-01 -0.30563E-01 2020 0.341E-01 0.350E+00 DAV: 15 -0.170767625285E+04 0.17140E-01 -0.72764E-02 1772 0.233E-01 0.215E+00 DAV: 16 -0.170767438986E+04 0.18630E-02 -0.28243E-02 1820 0.152E-01 0.172E+00 DAV: 17 -0.170767276436E+04 0.16255E-02 -0.13501E-02 1908 0.106E-01 0.115E+00 DAV: 18 -0.170767383203E+04 -0.10677E-02 -0.97198E-03 1876 0.870E-02 0.910E-01 DAV: 19 -0.170767325090E+04 0.58113E-03 -0.65177E-03 1852 0.773E-02 0.538E-01 DAV: 20 -0.170767331641E+04 -0.65513E-04 -0.23621E-03 1860 0.543E-02 0.337E-01 DAV: 21 -0.170767336924E+04 -0.52828E-04 -0.84876E-04 1788 0.306E-02 0.188E-01 DAV: 22 -0.170767342144E+04 -0.52201E-04 -0.41358E-04 1812 0.208E-02 0.133E-01 DAV: 23 -0.170767341277E+04 0.86708E-05 -0.20470E-04 1532 0.180E-02 0.114E-01 DAV: 24 -0.170767338844E+04 0.24328E-04 -0.12022E-04 1324 0.133E-02 0.764E-02 DAV: 25 -0.170767338770E+04 0.73764E-06 -0.81487E-05 1236 0.110E-02 5 T= 1562. E= -.16205941E+04 F= -.17076734E+04 E0= -.17075501E+04 EK= 0.64611E+02 SP= 0.44E+01 SK= 0.18E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.172048173175E+04 -0.12808E+02 -0.87526E+01 1538 0.175E+01 0.481E+00 DAV: 2 -0.172302030874E+04 -0.25386E+01 -0.16102E+01 1700 0.474E+00 0.190E+01 DAV: 3 -0.172175391074E+04 0.12664E+01 -0.32343E+00 1972 0.134E+00 0.924E+00 DAV: 4 -0.172257694515E+04 -0.82303E+00 -0.41359E+00 1908 0.106E+00 0.208E+01 DAV: 5 -0.172180032365E+04 0.77662E+00 -0.22604E+00 1804 0.820E-01 0.100E+01 DAV: 6 -0.172170766658E+04 0.92657E-01 -0.12751E+00 1868 0.663E-01 0.133E+01 DAV: 7 -0.172160775046E+04 0.99916E-01 -0.16549E+00 2052 0.617E-01 0.863E+00 DAV: 8 -0.172157672360E+04 0.31027E-01 -0.77338E-01 1908 0.605E-01 0.741E+00 DAV: 9 -0.172156844175E+04 0.82819E-02 -0.95224E-01 1924 0.616E-01 0.689E+00 DAV: 10 -0.172146495774E+04 0.10348E+00 -0.62982E-01 2036 0.585E-01 0.426E+00 DAV: 11 -0.172151783294E+04 -0.52875E-01 -0.39801E-01 1972 0.415E-01 0.628E+00 DAV: 12 -0.172145480724E+04 0.63026E-01 -0.45158E-01 1972 0.380E-01 0.348E+00 DAV: 13 -0.172145768166E+04 -0.28744E-02 -0.25936E-01 2004 0.382E-01 0.291E+00 DAV: 14 -0.172145852286E+04 -0.84119E-03 -0.12814E-01 1964 0.311E-01 0.288E+00 DAV: 15 -0.172144129749E+04 0.17225E-01 -0.11512E-01 2052 0.257E-01 0.162E+00 DAV: 16 -0.172143976494E+04 0.15326E-02 -0.48566E-02 1996 0.182E-01 0.114E+00 DAV: 17 -0.172143891967E+04 0.84527E-03 -0.23013E-02 1852 0.113E-01 0.897E-01 DAV: 18 -0.172143849230E+04 0.42737E-03 -0.19624E-02 1900 0.890E-02 0.908E-01 DAV: 19 -0.172143705563E+04 0.14367E-02 -0.58402E-03 1780 0.637E-02 0.387E-01 DAV: 20 -0.172143744259E+04 -0.38695E-03 -0.34513E-03 1884 0.476E-02 0.342E-01 DAV: 21 -0.172143714160E+04 0.30099E-03 -0.14646E-03 1932 0.375E-02 0.178E-01 DAV: 22 -0.172143711734E+04 0.24263E-04 -0.72184E-04 1884 0.258E-02 0.128E-01 DAV: 23 -0.172143707642E+04 0.40911E-04 -0.33252E-04 1828 0.178E-02 0.755E-02 DAV: 24 -0.172143707587E+04 0.55817E-06 -0.11763E-04 1332 0.121E-02 0.628E-02 DAV: 25 -0.172143707628E+04 -0.41550E-06 -0.46245E-05 1028 0.840E-03 6 T= 1410. E= -.16205783E+04 F= -.17214371E+04 E0= -.17213098E+04 EK= 0.58319E+02 SP= 0.83E+01 SK= 0.34E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.173210312763E+04 -0.10666E+02 -0.71938E+01 1530 0.159E+01 0.435E+00 DAV: 2 -0.173472791107E+04 -0.26248E+01 -0.15181E+01 1716 0.430E+00 0.219E+01 DAV: 3 -0.173298569669E+04 0.17422E+01 -0.28025E+00 1948 0.130E+00 0.822E+00 DAV: 4 -0.173396210817E+04 -0.97641E+00 -0.43764E+00 1916 0.102E+00 0.185E+01 DAV: 5 -0.173321074886E+04 0.75136E+00 -0.42159E+00 1836 0.744E-01 0.985E+00 DAV: 6 -0.173297796435E+04 0.23278E+00 -0.11693E+00 1972 0.627E-01 0.621E+00 DAV: 7 -0.173310254848E+04 -0.12458E+00 -0.12477E+00 1884 0.559E-01 0.862E+00 DAV: 8 -0.173297951811E+04 0.12303E+00 -0.71951E-01 1860 0.482E-01 0.451E+00 DAV: 9 -0.173302644582E+04 -0.46928E-01 -0.45959E-01 1900 0.436E-01 0.596E+00 DAV: 10 -0.173298629841E+04 0.40147E-01 -0.69747E-01 1940 0.447E-01 0.501E+00 DAV: 11 -0.173303801823E+04 -0.51720E-01 -0.65787E-01 1876 0.426E-01 0.680E+00 DAV: 12 -0.173294798945E+04 0.90029E-01 -0.30312E-01 1932 0.390E-01 0.320E+00 DAV: 13 -0.173295503533E+04 -0.70459E-02 -0.24041E-01 1916 0.309E-01 0.272E+00 DAV: 14 -0.173296123540E+04 -0.62001E-02 -0.16228E-01 1796 0.220E-01 0.324E+00 DAV: 15 -0.173294511766E+04 0.16118E-01 -0.76276E-02 1868 0.177E-01 0.139E+00 DAV: 16 -0.173294337396E+04 0.17437E-02 -0.42479E-02 1852 0.138E-01 0.975E-01 DAV: 17 -0.173294282196E+04 0.55200E-03 -0.12851E-02 1876 0.964E-02 0.527E-01 DAV: 18 -0.173294237720E+04 0.44476E-03 -0.55241E-03 1852 0.640E-02 0.253E-01 DAV: 19 -0.173294246619E+04 -0.88988E-04 -0.19536E-03 1836 0.430E-02 0.215E-01 DAV: 20 -0.173294235268E+04 0.11350E-03 -0.88118E-04 1844 0.289E-02 0.157E-01 DAV: 21 -0.173294235246E+04 0.22719E-06 -0.39062E-04 1804 0.209E-02 0.144E-01 DAV: 22 -0.173294230588E+04 0.46576E-04 -0.26147E-04 1572 0.155E-02 0.103E-01 DAV: 23 -0.173294229376E+04 0.12116E-04 -0.97196E-05 1324 0.109E-02 0.791E-02 DAV: 24 -0.173294229603E+04 -0.22637E-05 -0.56700E-05 1020 0.824E-03 7 T= 1161. E= -.16198529E+04 F= -.17329423E+04 E0= -.17328088E+04 EK= 0.48010E+02 SP= 0.13E+02 SK= 0.52E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.174354765785E+04 -0.10605E+02 -0.94431E+01 1522 0.166E+01 0.575E+00 DAV: 2 -0.174799266176E+04 -0.44450E+01 -0.18324E+01 1764 0.481E+00 0.259E+01 DAV: 3 -0.174497437785E+04 0.30183E+01 -0.63339E+00 1868 0.199E+00 0.145E+01 DAV: 4 -0.174522044454E+04 -0.24607E+00 -0.62045E+00 1972 0.144E+00 0.162E+01 DAV: 5 -0.174435411390E+04 0.86633E+00 -0.32267E+00 1844 0.104E+00 0.935E+00 DAV: 6 -0.174453773841E+04 -0.18362E+00 -0.18444E+00 1852 0.781E-01 0.143E+01 DAV: 7 -0.174463451459E+04 -0.96776E-01 -0.32855E+00 1868 0.774E-01 0.129E+01 DAV: 8 -0.174428991669E+04 0.34460E+00 -0.15946E+00 1940 0.701E-01 0.801E+00 DAV: 9 -0.174432340981E+04 -0.33493E-01 -0.13114E+00 1844 0.615E-01 0.850E+00 DAV: 10 -0.174423499246E+04 0.88417E-01 -0.87117E-01 1868 0.580E-01 0.531E+00 DAV: 11 -0.174427647891E+04 -0.41486E-01 -0.85054E-01 1964 0.534E-01 0.728E+00 DAV: 12 -0.174425446530E+04 0.22014E-01 -0.97428E-01 1916 0.456E-01 0.610E+00 DAV: 13 -0.174422961940E+04 0.24846E-01 -0.36350E-01 1932 0.438E-01 0.544E+00 DAV: 14 -0.174417060804E+04 0.59011E-01 -0.31971E-01 2004 0.331E-01 0.252E+00 DAV: 15 -0.174417483063E+04 -0.42226E-02 -0.16399E-01 2004 0.260E-01 0.172E+00 DAV: 16 -0.174417151001E+04 0.33206E-02 -0.86745E-02 1892 0.186E-01 0.127E+00 DAV: 17 -0.174416799077E+04 0.35192E-02 -0.31859E-02 1868 0.127E-01 0.721E-01 DAV: 18 -0.174416714817E+04 0.84260E-03 -0.10465E-02 1964 0.869E-02 0.400E-01 DAV: 19 -0.174416741334E+04 -0.26517E-03 -0.46110E-03 1924 0.680E-02 0.399E-01 DAV: 20 -0.174416705441E+04 0.35893E-03 -0.20106E-03 1972 0.496E-02 0.304E-01 DAV: 21 -0.174416680756E+04 0.24685E-03 -0.97694E-04 1980 0.329E-02 0.214E-01 DAV: 22 -0.174416679029E+04 0.17273E-04 -0.45672E-04 1852 0.201E-02 0.133E-01 DAV: 23 -0.174416678047E+04 0.98181E-05 -0.28359E-04 1540 0.145E-02 0.107E-01 DAV: 24 -0.174416676064E+04 0.19831E-04 -0.92429E-05 1244 0.107E-02 0.651E-02 DAV: 25 -0.174416676039E+04 0.24626E-06 -0.35820E-05 916 0.705E-03 8 T= 913. E= -.16196391E+04 F= -.17441668E+04 E0= -.17440364E+04 EK= 0.37760E+02 SP= 0.19E+02 SK= 0.68E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.175491337458E+04 -0.10747E+02 -0.16455E+02 1554 0.182E+01 0.753E+00 DAV: 2 -0.175964089889E+04 -0.47275E+01 -0.17504E+01 1756 0.488E+00 0.302E+01 DAV: 3 -0.175586451866E+04 0.37764E+01 -0.73013E+00 1916 0.211E+00 0.170E+01 DAV: 4 -0.175687869066E+04 -0.10142E+01 -0.55255E+00 1828 0.152E+00 0.157E+01 DAV: 5 -0.175590461589E+04 0.97407E+00 -0.24697E+00 2004 0.166E+00 0.161E+01 DAV: 6 -0.175550461115E+04 0.40000E+00 -0.38621E+00 1828 0.107E+00 0.133E+01 DAV: 7 -0.175564245788E+04 -0.13785E+00 -0.43359E+00 2076 0.112E+00 0.138E+01 DAV: 8 -0.175535003649E+04 0.29242E+00 -0.29725E+00 1972 0.950E-01 0.112E+01 DAV: 9 -0.175534217659E+04 0.78599E-02 -0.22350E+00 2020 0.810E-01 0.102E+01 DAV: 10 -0.175524034321E+04 0.10183E+00 -0.13486E+00 2036 0.821E-01 0.972E+00 DAV: 11 -0.175519710205E+04 0.43241E-01 -0.13163E+00 1900 0.638E-01 0.747E+00 DAV: 12 -0.175508149680E+04 0.11561E+00 -0.55635E-01 1948 0.527E-01 0.450E+00 DAV: 13 -0.175511894381E+04 -0.37447E-01 -0.54765E-01 1900 0.437E-01 0.511E+00 DAV: 14 -0.175508118791E+04 0.37756E-01 -0.57158E-01 1916 0.375E-01 0.390E+00 DAV: 15 -0.175505583085E+04 0.25357E-01 -0.15346E-01 1940 0.297E-01 0.213E+00 DAV: 16 -0.175505460042E+04 0.12304E-02 -0.67943E-02 1860 0.203E-01 0.138E+00 DAV: 17 -0.175505199438E+04 0.26060E-02 -0.45349E-02 1844 0.126E-01 0.862E-01 DAV: 18 -0.175505162553E+04 0.36886E-03 -0.16348E-02 1876 0.906E-02 0.586E-01 DAV: 19 -0.175505141269E+04 0.21283E-03 -0.62533E-03 1932 0.665E-02 0.454E-01 DAV: 20 -0.175505107599E+04 0.33670E-03 -0.50114E-03 1908 0.522E-02 0.287E-01 DAV: 21 -0.175505112528E+04 -0.49292E-04 -0.11249E-03 1844 0.382E-02 0.282E-01 DAV: 22 -0.175505100339E+04 0.12190E-03 -0.47924E-04 1932 0.273E-02 0.180E-01 DAV: 23 -0.175505093657E+04 0.66821E-04 -0.32966E-04 1708 0.178E-02 0.586E-02 DAV: 24 -0.175505094017E+04 -0.35994E-05 -0.79677E-05 1412 0.107E-02 9 T= 723. E= -.16189479E+04 F= -.17550509E+04 E0= -.17549233E+04 EK= 0.29904E+02 SP= 0.26E+02 SK= 0.80E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.176513978622E+04 -0.10089E+02 -0.12680E+02 1538 0.163E+01 0.596E+00 DAV: 2 -0.176957633589E+04 -0.44365E+01 -0.14941E+01 1804 0.441E+00 0.275E+01 DAV: 3 -0.176621517792E+04 0.33612E+01 -0.73913E+00 1908 0.194E+00 0.143E+01 DAV: 4 -0.176616482815E+04 0.50350E-01 -0.42400E+00 1948 0.130E+00 0.128E+01 DAV: 5 -0.176642587421E+04 -0.26105E+00 -0.34675E+00 1892 0.114E+00 0.151E+01 DAV: 6 -0.176610822070E+04 0.31765E+00 -0.37778E+00 1932 0.909E-01 0.153E+01 DAV: 7 -0.176571394079E+04 0.39428E+00 -0.16531E+00 1964 0.755E-01 0.788E+00 DAV: 8 -0.176575764554E+04 -0.43705E-01 -0.97252E-01 1964 0.730E-01 0.769E+00 DAV: 9 -0.176579152704E+04 -0.33881E-01 -0.11755E+00 1908 0.581E-01 0.114E+01 DAV: 10 -0.176570690644E+04 0.84621E-01 -0.15614E+00 1948 0.508E-01 0.712E+00 DAV: 11 -0.176570661005E+04 0.29639E-03 -0.10275E+00 1972 0.527E-01 0.688E+00 DAV: 12 -0.176562560184E+04 0.81008E-01 -0.49556E-01 1860 0.412E-01 0.496E+00 DAV: 13 -0.176559625805E+04 0.29344E-01 -0.26874E-01 1892 0.359E-01 0.289E+00 DAV: 14 -0.176560374736E+04 -0.74893E-02 -0.22021E-01 1884 0.263E-01 0.255E+00 DAV: 15 -0.176561012486E+04 -0.63775E-02 -0.11353E-01 1956 0.236E-01 0.294E+00 DAV: 16 -0.176559594875E+04 0.14176E-01 -0.11899E-01 1956 0.188E-01 0.214E+00 DAV: 17 -0.176559115669E+04 0.47921E-02 -0.31684E-02 1884 0.151E-01 0.920E-01 DAV: 18 -0.176559105398E+04 0.10272E-03 -0.96842E-03 1796 0.890E-02 0.459E-01 DAV: 19 -0.176559100893E+04 0.45041E-04 -0.27417E-03 1836 0.581E-02 0.273E-01 DAV: 20 -0.176559099975E+04 0.91818E-05 -0.15852E-03 1868 0.381E-02 0.197E-01 DAV: 21 -0.176559101132E+04 -0.11562E-04 -0.78484E-04 1868 0.276E-02 0.162E-01 DAV: 22 -0.176559093993E+04 0.71388E-04 -0.26255E-04 1796 0.217E-02 0.109E-01 DAV: 23 -0.176559092914E+04 0.10784E-04 -0.13389E-04 1500 0.128E-02 0.740E-02 DAV: 24 -0.176559091631E+04 0.12829E-04 -0.10428E-04 1156 0.839E-03 0.379E-02 DAV: 25 -0.176559091786E+04 -0.15435E-05 -0.30188E-05 892 0.608E-03 10 T= 585. E= -.16180821E+04 F= -.17655909E+04 E0= -.17654630E+04 EK= 0.24203E+02 SP= 0.33E+02 SK= 0.90E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.177373951482E+04 -0.81486E+01 -0.51976E+01 1570 0.116E+01 0.377E+00 DAV: 2 -0.177534922828E+04 -0.16097E+01 -0.74146E+00 1756 0.322E+00 0.173E+01 DAV: 3 -0.177495434187E+04 0.39489E+00 -0.44388E+00 1908 0.137E+00 0.224E+01 DAV: 4 -0.177436043548E+04 0.59391E+00 -0.34422E+00 1740 0.720E-01 0.108E+01 DAV: 5 -0.177408341841E+04 0.27702E+00 -0.10008E+00 2044 0.827E-01 0.572E+00 DAV: 6 -0.177441909345E+04 -0.33568E+00 -0.15701E+00 1900 0.671E-01 0.137E+01 DAV: 7 -0.177407462341E+04 0.34447E+00 -0.87169E-01 1980 0.512E-01 0.562E+00 DAV: 8 -0.177407195793E+04 0.26655E-02 -0.43175E-01 1884 0.434E-01 0.475E+00 DAV: 9 -0.177408453171E+04 -0.12574E-01 -0.44068E-01 1868 0.420E-01 0.577E+00 DAV: 10 -0.177411293461E+04 -0.28403E-01 -0.63741E-01 1916 0.363E-01 0.595E+00 DAV: 11 -0.177405490471E+04 0.58030E-01 -0.45915E-01 1956 0.380E-01 0.394E+00 DAV: 12 -0.177406696194E+04 -0.12057E-01 -0.42986E-01 1948 0.336E-01 0.427E+00 DAV: 13 -0.177403416790E+04 0.32794E-01 -0.27551E-01 1932 0.311E-01 0.253E+00 DAV: 14 -0.177403504160E+04 -0.87370E-03 -0.12483E-01 1828 0.207E-01 0.197E+00 DAV: 15 -0.177402991316E+04 0.51284E-02 -0.73988E-02 1852 0.169E-01 0.170E+00 DAV: 16 -0.177402829350E+04 0.16197E-02 -0.37523E-02 1836 0.123E-01 0.136E+00 DAV: 17 -0.177402472307E+04 0.35704E-02 -0.14497E-02 1844 0.929E-02 0.529E-01 DAV: 18 -0.177402603205E+04 -0.13090E-02 -0.97206E-03 1876 0.680E-02 0.447E-01 DAV: 19 -0.177402562176E+04 0.41029E-03 -0.32891E-03 1868 0.479E-02 0.271E-01 DAV: 20 -0.177402563178E+04 -0.10027E-04 -0.77403E-04 1932 0.307E-02 0.182E-01 DAV: 21 -0.177402565979E+04 -0.28010E-04 -0.29892E-04 1868 0.218E-02 0.144E-01 DAV: 22 -0.177402562490E+04 0.34890E-04 -0.12209E-04 1588 0.159E-02 0.812E-02 DAV: 23 -0.177402561819E+04 0.67111E-05 -0.76352E-05 1236 0.987E-03 11 T= 465. E= -.16167415E+04 F= -.17740256E+04 E0= -.17738914E+04 EK= 0.19247E+02 SP= 0.40E+02 SK= 0.98E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.178103724399E+04 -0.70116E+01 -0.44039E+01 1570 0.102E+01 0.350E+00 DAV: 2 -0.178207631061E+04 -0.10391E+01 -0.54805E+00 1740 0.264E+00 0.167E+01 DAV: 3 -0.178150310046E+04 0.57321E+00 -0.28760E+00 1828 0.948E-01 0.162E+01 DAV: 4 -0.178147791372E+04 0.25187E-01 -0.33100E+00 1708 0.495E-01 0.987E+00 DAV: 5 -0.178163579091E+04 -0.15788E+00 -0.17647E+00 1908 0.624E-01 0.146E+01 DAV: 6 -0.178132023904E+04 0.31555E+00 -0.10479E+00 1852 0.558E-01 0.752E+00 DAV: 7 -0.178139353583E+04 -0.73297E-01 -0.13655E+00 1940 0.544E-01 0.906E+00 DAV: 8 -0.178129527256E+04 0.98263E-01 -0.12105E+00 1884 0.532E-01 0.733E+00 DAV: 9 -0.178127195190E+04 0.23321E-01 -0.10625E+00 1964 0.436E-01 0.552E+00 DAV: 10 -0.178129884197E+04 -0.26890E-01 -0.58586E-01 2020 0.426E-01 0.490E+00 DAV: 11 -0.178127205078E+04 0.26791E-01 -0.44645E-01 2012 0.412E-01 0.479E+00 DAV: 12 -0.178122416423E+04 0.47887E-01 -0.31301E-01 1916 0.290E-01 0.213E+00 DAV: 13 -0.178123460864E+04 -0.10444E-01 -0.96221E-02 1924 0.250E-01 0.186E+00 DAV: 14 -0.178122937525E+04 0.52334E-02 -0.81458E-02 1908 0.182E-01 0.124E+00 DAV: 15 -0.178122564051E+04 0.37347E-02 -0.20112E-02 1924 0.127E-01 0.818E-01 DAV: 16 -0.178122822402E+04 -0.25835E-02 -0.22112E-02 1940 0.966E-02 0.122E+00 DAV: 17 -0.178122449791E+04 0.37261E-02 -0.13494E-02 1972 0.803E-02 0.597E-01 DAV: 18 -0.178122460963E+04 -0.11172E-03 -0.70848E-03 1852 0.599E-02 0.370E-01 DAV: 19 -0.178122442461E+04 0.18502E-03 -0.24430E-03 1844 0.378E-02 0.198E-01 DAV: 20 -0.178122440271E+04 0.21893E-04 -0.71227E-04 1924 0.268E-02 0.114E-01 DAV: 21 -0.178122439087E+04 0.11844E-04 -0.20688E-04 1708 0.171E-02 0.706E-02 DAV: 22 -0.178122438873E+04 0.21355E-05 -0.10131E-04 1300 0.116E-02 0.563E-02 DAV: 23 -0.178122438485E+04 0.38837E-05 -0.73496E-05 1004 0.776E-03 12 T= 371. E= -.16154354E+04 F= -.17812244E+04 E0= -.17810830E+04 EK= 0.15336E+02 SP= 0.48E+02 SK= 0.10E+03 N E dE d eps ncg rms rms(c) DAV: 1 -0.178640751937E+04 -0.51831E+01 -0.21644E+01 1546 0.810E+00 0.252E+00 DAV: 2 -0.178730257584E+04 -0.89506E+00 -0.46687E+00 1708 0.227E+00 0.133E+01 DAV: 3 -0.178684660596E+04 0.45597E+00 -0.35608E+00 1836 0.915E-01 0.931E+00 DAV: 4 -0.178670022015E+04 0.14639E+00 -0.14421E+00 1932 0.658E-01 0.729E+00 DAV: 5 -0.178674245433E+04 -0.42234E-01 -0.91517E-01 1828 0.448E-01 0.104E+01 DAV: 6 -0.178672060057E+04 0.21854E-01 -0.95447E-01 1828 0.349E-01 0.882E+00 DAV: 7 -0.178667347454E+04 0.47126E-01 -0.13488E+00 1812 0.359E-01 0.648E+00 DAV: 8 -0.178660140043E+04 0.72074E-01 -0.52721E-01 1940 0.380E-01 0.281E+00 DAV: 9 -0.178663403226E+04 -0.32632E-01 -0.19351E-01 1876 0.294E-01 0.314E+00 DAV: 10 -0.178663301917E+04 0.10131E-02 -0.30162E-01 1892 0.271E-01 0.336E+00 DAV: 11 -0.178661709491E+04 0.15924E-01 -0.18244E-01 1900 0.256E-01 0.239E+00 DAV: 12 -0.178663852103E+04 -0.21426E-01 -0.14612E-01 1908 0.240E-01 0.362E+00 DAV: 13 -0.178660636914E+04 0.32152E-01 -0.15183E-01 1996 0.212E-01 0.182E+00 DAV: 14 -0.178661985269E+04 -0.13484E-01 -0.63541E-02 1796 0.158E-01 0.240E+00 DAV: 15 -0.178660345052E+04 0.16402E-01 -0.59158E-02 1868 0.142E-01 0.622E-01 DAV: 16 -0.178660747920E+04 -0.40287E-02 -0.10712E-02 1796 0.883E-02 0.372E-01 DAV: 17 -0.178660733794E+04 0.14126E-03 -0.43221E-03 1844 0.548E-02 0.252E-01 DAV: 18 -0.178660728684E+04 0.51103E-04 -0.19155E-03 1900 0.343E-02 0.239E-01 DAV: 19 -0.178660714936E+04 0.13748E-03 -0.89003E-04 1932 0.232E-02 0.154E-01 DAV: 20 -0.178660711548E+04 0.33877E-04 -0.28812E-04 1692 0.187E-02 0.860E-02 DAV: 21 -0.178660709475E+04 0.20738E-04 -0.14941E-04 1460 0.130E-02 0.461E-02 DAV: 22 -0.178660709537E+04 -0.62144E-06 -0.55986E-05 1076 0.803E-03 13 T= 290. E= -.16139264E+04 F= -.17866071E+04 E0= -.17864609E+04 EK= 0.11992E+02 SP= 0.56E+02 SK= 0.10E+03 N E dE d eps ncg rms rms(c) DAV: 1 -0.179139281148E+04 -0.47857E+01 -0.31544E+01 1594 0.823E+00 0.263E+00 DAV: 2 -0.179213332272E+04 -0.74051E+00 -0.37285E+00 1748 0.210E+00 0.147E+01 DAV: 3 -0.179162664915E+04 0.50667E+00 -0.21906E+00 1812 0.830E-01 0.114E+01 DAV: 4 -0.179175423126E+04 -0.12758E+00 -0.21483E+00 1740 0.462E-01 0.100E+01 DAV: 5 -0.179163682768E+04 0.11740E+00 -0.10973E+00 2012 0.535E-01 0.715E+00 DAV: 6 -0.179160954909E+04 0.27279E-01 -0.90643E-01 1868 0.476E-01 0.681E+00 DAV: 7 -0.179160283424E+04 0.67148E-02 -0.73833E-01 1980 0.456E-01 0.649E+00 DAV: 8 -0.179153802900E+04 0.64805E-01 -0.69912E-01 1900 0.385E-01 0.446E+00 DAV: 9 -0.179157254610E+04 -0.34517E-01 -0.35484E-01 1804 0.308E-01 0.544E+00 DAV: 10 -0.179157345955E+04 -0.91345E-03 -0.43203E-01 1924 0.339E-01 0.456E+00 DAV: 11 -0.179153720127E+04 0.36258E-01 -0.32314E-01 1924 0.324E-01 0.341E+00 DAV: 12 -0.179153323930E+04 0.39620E-02 -0.24200E-01 1852 0.239E-01 0.272E+00 DAV: 13 -0.179152855856E+04 0.46807E-02 -0.94706E-02 1916 0.231E-01 0.178E+00 DAV: 14 -0.179152348327E+04 0.50753E-02 -0.79466E-02 1884 0.166E-01 0.118E+00 DAV: 15 -0.179152282374E+04 0.65953E-03 -0.20412E-02 1820 0.108E-01 0.680E-01 DAV: 16 -0.179152282882E+04 -0.50822E-05 -0.10369E-02 1876 0.845E-02 0.638E-01 DAV: 17 -0.179152166170E+04 0.11671E-02 -0.60833E-03 2020 0.589E-02 0.300E-01 DAV: 18 -0.179152165205E+04 0.96504E-05 -0.13742E-03 1964 0.418E-02 0.158E-01 DAV: 19 -0.179152163361E+04 0.18438E-04 -0.55196E-04 1908 0.258E-02 0.962E-02 DAV: 20 -0.179152162613E+04 0.74834E-05 -0.27953E-04 1764 0.161E-02 0.746E-02 DAV: 21 -0.179152161514E+04 0.10987E-04 -0.14869E-04 1316 0.113E-02 0.520E-02 DAV: 22 -0.179152161210E+04 0.30468E-05 -0.66428E-05 1068 0.821E-03 14 T= 237. E= -.16125310E+04 F= -.17915216E+04 E0= -.17913749E+04 EK= 0.98033E+01 SP= 0.64E+02 SK= 0.11E+03 N E dE d eps ncg rms rms(c) DAV: 1 -0.179594857210E+04 -0.44270E+01 -0.20464E+01 1602 0.693E+00 0.235E+00 DAV: 2 -0.179649189930E+04 -0.54333E+00 -0.28626E+00 1756 0.187E+00 0.102E+01 DAV: 3 -0.179614058804E+04 0.35131E+00 -0.13595E+00 1892 0.743E-01 0.758E+00 DAV: 4 -0.179627338908E+04 -0.13280E+00 -0.17873E+00 1788 0.430E-01 0.107E+01 DAV: 5 -0.179612748147E+04 0.14591E+00 -0.76842E-01 1948 0.455E-01 0.676E+00 DAV: 6 -0.179618743378E+04 -0.59952E-01 -0.11389E+00 1892 0.406E-01 0.860E+00 DAV: 7 -0.179611611197E+04 0.71322E-01 -0.99817E-01 1924 0.378E-01 0.603E+00 DAV: 8 -0.179608779443E+04 0.28318E-01 -0.43490E-01 1852 0.340E-01 0.404E+00 DAV: 9 -0.179611214701E+04 -0.24353E-01 -0.31640E-01 1900 0.326E-01 0.454E+00 DAV: 10 -0.179606136326E+04 0.50784E-01 -0.35441E-01 1852 0.312E-01 0.214E+00 DAV: 11 -0.179609011773E+04 -0.28754E-01 -0.17644E-01 1908 0.266E-01 0.333E+00 DAV: 12 -0.179606616557E+04 0.23952E-01 -0.21625E-01 1876 0.215E-01 0.225E+00 DAV: 13 -0.179606884799E+04 -0.26824E-02 -0.91783E-02 1908 0.194E-01 0.152E+00 DAV: 14 -0.179606532562E+04 0.35224E-02 -0.32909E-02 1892 0.147E-01 0.760E-01 DAV: 15 -0.179606469673E+04 0.62889E-03 -0.18497E-02 1940 0.877E-02 0.550E-01 DAV: 16 -0.179606381301E+04 0.88372E-03 -0.61538E-03 1844 0.588E-02 0.288E-01 DAV: 17 -0.179606369590E+04 0.11711E-03 -0.12839E-03 1804 0.386E-02 0.170E-01 DAV: 18 -0.179606372486E+04 -0.28956E-04 -0.11759E-03 1820 0.250E-02 0.160E-01 DAV: 19 -0.179606371835E+04 0.65067E-05 -0.94538E-04 1812 0.186E-02 0.143E-01 DAV: 20 -0.179606363155E+04 0.86795E-04 -0.29897E-04 1388 0.148E-02 0.454E-02 DAV: 21 -0.179606365000E+04 -0.18447E-04 -0.71574E-05 1372 0.985E-03 0.370E-02 DAV: 22 -0.179606364548E+04 0.45227E-05 -0.33627E-05 988 0.678E-03 15 T= 203. E= -.16112111E+04 F= -.17960636E+04 E0= -.17959208E+04 EK= 0.83801E+01 SP= 0.72E+02 SK= 0.10E+03 N E dE d eps ncg rms rms(c) DAV: 1 -0.180003678006E+04 -0.39731E+01 -0.14194E+01 1610 0.593E+00 0.202E+00 DAV: 2 -0.180044610833E+04 -0.40933E+00 -0.24395E+00 1740 0.164E+00 0.855E+00 DAV: 3 -0.180030809725E+04 0.13801E+00 -0.16522E+00 1924 0.652E-01 0.101E+01 DAV: 4 -0.180020812653E+04 0.99971E-01 -0.71629E-01 1812 0.435E-01 0.890E+00 DAV: 5 -0.180019139025E+04 0.16736E-01 -0.10023E+00 1844 0.365E-01 0.634E+00 DAV: 6 -0.180016542742E+04 0.25963E-01 -0.66267E-01 1916 0.388E-01 0.497E+00 DAV: 7 -0.180015814052E+04 0.72869E-02 -0.37130E-01 1868 0.319E-01 0.522E+00 DAV: 8 -0.180012328939E+04 0.34851E-01 -0.38020E-01 1900 0.256E-01 0.321E+00 DAV: 9 -0.180013424261E+04 -0.10953E-01 -0.28652E-01 1756 0.253E-01 0.311E+00 DAV: 10 -0.180011944552E+04 0.14797E-01 -0.14599E-01 1828 0.218E-01 0.176E+00 DAV: 11 -0.180013338563E+04 -0.13940E-01 -0.90461E-02 1900 0.217E-01 0.240E+00 DAV: 12 -0.180012393996E+04 0.94457E-02 -0.99673E-02 1900 0.167E-01 0.206E+00 DAV: 13 -0.180012219594E+04 0.17440E-02 -0.55657E-02 1892 0.150E-01 0.135E+00 DAV: 14 -0.180011862523E+04 0.35707E-02 -0.20667E-02 1860 0.119E-01 0.751E-01 DAV: 15 -0.180011852818E+04 0.97052E-04 -0.60087E-03 1860 0.727E-02 0.415E-01 DAV: 16 -0.180011820813E+04 0.32006E-03 -0.22383E-03 1852 0.438E-02 0.161E-01 DAV: 17 -0.180011830942E+04 -0.10129E-03 -0.86514E-04 1892 0.288E-02 0.158E-01 DAV: 18 -0.180011825108E+04 0.58337E-04 -0.73271E-04 1828 0.186E-02 0.125E-01 DAV: 19 -0.180011819489E+04 0.56189E-04 -0.27722E-04 1468 0.142E-02 0.532E-02 DAV: 20 -0.180011819352E+04 0.13700E-05 -0.75186E-05 1268 0.985E-03 16 T= 178. E= -.16098966E+04 F= -.18001182E+04 E0= -.17999813E+04 EK= 0.73606E+01 SP= 0.79E+02 SK= 0.10E+03 N E dE d eps ncg rms rms(c) DAV: 1 -0.180390517901E+04 -0.37870E+01 -0.11999E+01 1570 0.542E+00 0.173E+00 DAV: 2 -0.180417707875E+04 -0.27190E+00 -0.20827E+00 1692 0.143E+00 0.897E+00 DAV: 3 -0.180404846623E+04 0.12861E+00 -0.15969E+00 1796 0.457E-01 0.710E+00 DAV: 4 -0.180411874654E+04 -0.70280E-01 -0.85622E-01 1900 0.405E-01 0.101E+01 DAV: 5 -0.180403442732E+04 0.84319E-01 -0.13886E+00 1804 0.340E-01 0.668E+00 DAV: 6 -0.180401843236E+04 0.15995E-01 -0.55496E-01 1916 0.323E-01 0.484E+00 DAV: 7 -0.180398748477E+04 0.30948E-01 -0.51920E-01 1852 0.318E-01 0.282E+00 DAV: 8 -0.180399229098E+04 -0.48062E-02 -0.14729E-01 1876 0.252E-01 0.234E+00 DAV: 9 -0.180399555704E+04 -0.32661E-02 -0.13514E-01 1908 0.223E-01 0.236E+00 DAV: 10 -0.180399887885E+04 -0.33218E-02 -0.11707E-01 1948 0.211E-01 0.232E+00 DAV: 11 -0.180399054941E+04 0.83294E-02 -0.89365E-02 2012 0.209E-01 0.201E+00 DAV: 12 -0.180398813871E+04 0.24107E-02 -0.80977E-02 1900 0.158E-01 0.183E+00 DAV: 13 -0.180398462403E+04 0.35147E-02 -0.42728E-02 1804 0.130E-01 0.117E+00 DAV: 14 -0.180398208556E+04 0.25385E-02 -0.13823E-02 1924 0.108E-01 0.544E-01 DAV: 15 -0.180398217460E+04 -0.89041E-04 -0.47342E-03 1836 0.604E-02 0.317E-01 DAV: 16 -0.180398194181E+04 0.23279E-03 -0.28301E-03 1812 0.368E-02 0.183E-01 DAV: 17 -0.180398201401E+04 -0.72198E-04 -0.19380E-03 1900 0.258E-02 0.178E-01 DAV: 18 -0.180398186066E+04 0.15334E-03 -0.92541E-04 1788 0.215E-02 0.743E-02 DAV: 19 -0.180398186016E+04 0.50820E-06 -0.16608E-04 1548 0.132E-02 0.488E-02 DAV: 20 -0.180398185994E+04 0.21737E-06 -0.72900E-05 1164 0.860E-03 17 T= 162. E= -.16087068E+04 F= -.18039819E+04 E0= -.18038511E+04 EK= 0.66923E+01 SP= 0.87E+02 SK= 0.10E+03 N E dE d eps ncg rms rms(c) DAV: 1 -0.180746768483E+04 -0.34858E+01 -0.83541E+00 1658 0.473E+00 0.156E+00 DAV: 2 -0.180778403250E+04 -0.31635E+00 -0.18862E+00 1708 0.137E+00 0.960E+00 DAV: 3 -0.180758128313E+04 0.20275E+00 -0.17785E+00 1828 0.506E-01 0.650E+00 DAV: 4 -0.180760826350E+04 -0.26980E-01 -0.10098E+00 1844 0.390E-01 0.684E+00 DAV: 5 -0.180758981196E+04 0.18452E-01 -0.58794E-01 1700 0.293E-01 0.660E+00 DAV: 6 -0.180758068223E+04 0.91297E-02 -0.53421E-01 2036 0.279E-01 0.506E+00 DAV: 7 -0.180752921277E+04 0.51469E-01 -0.43141E-01 1764 0.271E-01 0.204E+00 DAV: 8 -0.180754408044E+04 -0.14868E-01 -0.59581E-02 1852 0.215E-01 0.165E+00 DAV: 9 -0.180755235537E+04 -0.82749E-02 -0.11170E-01 1916 0.174E-01 0.268E+00 DAV: 10 -0.180753648203E+04 0.15873E-01 -0.10699E-01 1900 0.175E-01 0.132E+00 DAV: 11 -0.180754281352E+04 -0.63315E-02 -0.50045E-02 1924 0.162E-01 0.135E+00 DAV: 12 -0.180754036027E+04 0.24533E-02 -0.50075E-02 1804 0.122E-01 0.129E+00 DAV: 13 -0.180753793531E+04 0.24250E-02 -0.19815E-02 1836 0.103E-01 0.779E-01 DAV: 14 -0.180753666070E+04 0.12746E-02 -0.12354E-02 1900 0.731E-02 0.417E-01 DAV: 15 -0.180753676176E+04 -0.10106E-03 -0.39284E-03 1900 0.530E-02 0.326E-01 DAV: 16 -0.180753643472E+04 0.32704E-03 -0.14808E-03 1828 0.347E-02 0.134E-01 DAV: 17 -0.180753650135E+04 -0.66625E-04 -0.52478E-04 1796 0.206E-02 0.106E-01 DAV: 18 -0.180753657478E+04 -0.73429E-04 -0.79419E-04 1572 0.160E-02 0.176E-01 DAV: 19 -0.180753644092E+04 0.13385E-03 -0.48645E-04 1324 0.135E-02 0.452E-02 DAV: 20 -0.180753647487E+04 -0.33950E-04 -0.50107E-05 1100 0.883E-03 0.370E-02 DAV: 21 -0.180753647134E+04 0.35321E-05 -0.21746E-05 964 0.563E-03 18 T= 149. E= -.16075863E+04 F= -.18075365E+04 E0= -.18074095E+04 EK= 0.61738E+01 SP= 0.95E+02 SK= 0.99E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.181091754337E+04 -0.33811E+01 -0.88171E+00 1618 0.471E+00 0.160E+00 DAV: 2 -0.181118463196E+04 -0.26709E+00 -0.16087E+00 1724 0.126E+00 0.107E+01 DAV: 3 -0.181099296523E+04 0.19167E+00 -0.15279E+00 1732 0.419E-01 0.716E+00 DAV: 4 -0.181108602258E+04 -0.93057E-01 -0.12929E+00 1788 0.356E-01 0.781E+00 DAV: 5 -0.181099276036E+04 0.93262E-01 -0.54578E-01 1836 0.368E-01 0.466E+00 DAV: 6 -0.181100071993E+04 -0.79596E-02 -0.35682E-01 1900 0.313E-01 0.473E+00 DAV: 7 -0.181096746894E+04 0.33251E-01 -0.44067E-01 1780 0.277E-01 0.256E+00 DAV: 8 -0.181097277219E+04 -0.53033E-02 -0.91166E-02 1876 0.230E-01 0.185E+00 DAV: 9 -0.181099122207E+04 -0.18450E-01 -0.11725E-01 1956 0.213E-01 0.313E+00 DAV: 10 -0.181096835276E+04 0.22869E-01 -0.13828E-01 1964 0.201E-01 0.159E+00 DAV: 11 -0.181097024734E+04 -0.18946E-02 -0.63454E-02 1892 0.171E-01 0.113E+00 DAV: 12 -0.181096874804E+04 0.14993E-02 -0.24842E-02 1852 0.130E-01 0.715E-01 DAV: 13 -0.181096805690E+04 0.69115E-03 -0.15762E-02 1844 0.777E-02 0.552E-01 DAV: 14 -0.181096813481E+04 -0.77917E-04 -0.53302E-03 1788 0.557E-02 0.496E-01 DAV: 15 -0.181096746180E+04 0.67302E-03 -0.38216E-03 1900 0.383E-02 0.236E-01 DAV: 16 -0.181096740371E+04 0.58081E-04 -0.19112E-03 1788 0.277E-02 0.104E-01 DAV: 17 -0.181096741965E+04 -0.15932E-04 -0.67884E-04 1700 0.195E-02 0.897E-02 DAV: 18 -0.181096737369E+04 0.45953E-04 -0.22866E-04 1452 0.125E-02 0.332E-02 DAV: 19 -0.181096737690E+04 -0.32090E-05 -0.56322E-05 1092 0.784E-03 19 T= 141. E= -.16065844E+04 F= -.18109674E+04 E0= -.18108387E+04 EK= 0.58327E+01 SP= 0.10E+03 SK= 0.96E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.181422745257E+04 -0.32601E+01 -0.57254E+00 1642 0.411E+00 0.135E+00 DAV: 2 -0.181453311861E+04 -0.30567E+00 -0.17429E+00 1724 0.120E+00 0.109E+01 DAV: 3 -0.181429696045E+04 0.23616E+00 -0.12070E+00 1708 0.413E-01 0.673E+00 DAV: 4 -0.181432562884E+04 -0.28668E-01 -0.75988E-01 1836 0.343E-01 0.497E+00 DAV: 5 -0.181432114860E+04 0.44802E-02 -0.37461E-01 1860 0.308E-01 0.486E+00 DAV: 6 -0.181429252837E+04 0.28620E-01 -0.34075E-01 1820 0.267E-01 0.340E+00 DAV: 7 -0.181428470223E+04 0.78261E-02 -0.25332E-01 1844 0.193E-01 0.236E+00 DAV: 8 -0.181428387655E+04 0.82568E-03 -0.78334E-02 1868 0.182E-01 0.144E+00 DAV: 9 -0.181428713540E+04 -0.32589E-02 -0.53272E-02 1860 0.166E-01 0.138E+00 DAV: 10 -0.181428885250E+04 -0.17171E-02 -0.77730E-02 1940 0.157E-01 0.173E+00 DAV: 11 -0.181428523678E+04 0.36157E-02 -0.43121E-02 1924 0.141E-01 0.146E+00 DAV: 12 -0.181428223124E+04 0.30055E-02 -0.40040E-02 1908 0.118E-01 0.752E-01 DAV: 13 -0.181428169018E+04 0.54106E-03 -0.12319E-02 1884 0.899E-02 0.517E-01 DAV: 14 -0.181428146360E+04 0.22658E-03 -0.49108E-03 1876 0.586E-02 0.304E-01 DAV: 15 -0.181428144485E+04 0.18753E-04 -0.20181E-03 1900 0.367E-02 0.255E-01 DAV: 16 -0.181428119638E+04 0.24847E-03 -0.11834E-03 1908 0.268E-02 0.100E-01 DAV: 17 -0.181428126541E+04 -0.69038E-04 -0.37842E-04 1732 0.174E-02 0.102E-01 DAV: 18 -0.181428121684E+04 0.48575E-04 -0.24788E-04 1348 0.112E-02 0.478E-02 DAV: 19 -0.181428121885E+04 -0.20148E-05 -0.76268E-05 1156 0.777E-03 20 T= 136. E= -.16056491E+04 F= -.18142812E+04 E0= -.18141496E+04 EK= 0.56271E+01 SP= 0.11E+03 SK= 0.93E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.181759475738E+04 -0.33135E+01 -0.40107E+00 1572 0.376E+00 0.130E+00 DAV: 2 -0.181793557520E+04 -0.34082E+00 -0.14534E+00 1764 0.117E+00 0.104E+01 DAV: 3 -0.181779911876E+04 0.13646E+00 -0.15277E+00 1812 0.474E-01 0.130E+01 DAV: 4 -0.181762743546E+04 0.17168E+00 -0.80512E-01 1748 0.302E-01 0.257E+00 DAV: 5 -0.181769308629E+04 -0.65651E-01 -0.27026E-01 1796 0.268E-01 0.440E+00 DAV: 6 -0.181766301315E+04 0.30073E-01 -0.22773E-01 1828 0.237E-01 0.320E+00 DAV: 7 -0.181765229599E+04 0.10717E-01 -0.16766E-01 1844 0.183E-01 0.191E+00 DAV: 8 -0.181765352494E+04 -0.12289E-02 -0.12071E-01 1820 0.169E-01 0.170E+00 DAV: 9 -0.181765600552E+04 -0.24806E-02 -0.12856E-01 1924 0.140E-01 0.215E+00 DAV: 10 -0.181764792646E+04 0.80791E-02 -0.62949E-02 1884 0.140E-01 0.107E+00 DAV: 11 -0.181765092236E+04 -0.29959E-02 -0.40388E-02 1956 0.131E-01 0.923E-01 DAV: 12 -0.181764920944E+04 0.17129E-02 -0.23715E-02 1956 0.105E-01 0.702E-01 DAV: 13 -0.181764920481E+04 0.46354E-05 -0.21088E-02 1844 0.763E-02 0.620E-01 DAV: 14 -0.181764802826E+04 0.11765E-02 -0.53266E-03 1884 0.584E-02 0.252E-01 DAV: 15 -0.181764830919E+04 -0.28092E-03 -0.22018E-03 1884 0.363E-02 0.280E-01 DAV: 16 -0.181764802858E+04 0.28060E-03 -0.12638E-03 1924 0.275E-02 0.106E-01 DAV: 17 -0.181764807132E+04 -0.42737E-04 -0.25721E-04 1780 0.155E-02 0.752E-02 DAV: 18 -0.181764805409E+04 0.17233E-04 -0.10663E-04 1308 0.949E-03 0.432E-02 DAV: 19 -0.181764805954E+04 -0.54542E-05 -0.61397E-05 1004 0.690E-03 21 T= 135. E= -.16047903E+04 F= -.18176481E+04 E0= -.18175157E+04 EK= 0.56047E+01 SP= 0.12E+03 SK= 0.90E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.182099504069E+04 -0.33470E+01 -0.96649E+00 1578 0.466E+00 0.220E+00 DAV: 2 -0.182169319907E+04 -0.69816E+00 -0.24134E+00 1836 0.162E+00 0.137E+01 DAV: 3 -0.182159567761E+04 0.97521E-01 -0.22825E+00 1924 0.825E-01 0.202E+01 DAV: 4 -0.182100715301E+04 0.58852E+00 -0.35195E+00 1780 0.438E-01 0.376E+00 DAV: 5 -0.182112877769E+04 -0.12162E+00 -0.64249E-01 1836 0.440E-01 0.606E+00 DAV: 6 -0.182104246105E+04 0.86317E-01 -0.55665E-01 1844 0.375E-01 0.328E+00 DAV: 7 -0.182108501632E+04 -0.42555E-01 -0.41819E-01 1860 0.283E-01 0.485E+00 DAV: 8 -0.182104166759E+04 0.43349E-01 -0.33005E-01 1876 0.252E-01 0.236E+00 DAV: 9 -0.182104807205E+04 -0.64045E-02 -0.16834E-01 1852 0.218E-01 0.237E+00 DAV: 10 -0.182105400755E+04 -0.59355E-02 -0.21931E-01 1932 0.200E-01 0.322E+00 DAV: 11 -0.182103561630E+04 0.18391E-01 -0.15497E-01 1812 0.192E-01 0.174E+00 DAV: 12 -0.182103684614E+04 -0.12298E-02 -0.61996E-02 1892 0.164E-01 0.109E+00 DAV: 13 -0.182103737273E+04 -0.52660E-03 -0.36631E-02 1900 0.138E-01 0.882E-01 DAV: 14 -0.182103552842E+04 0.18443E-02 -0.18673E-02 1876 0.994E-02 0.582E-01 DAV: 15 -0.182103488727E+04 0.64115E-03 -0.68142E-03 1908 0.588E-02 0.352E-01 DAV: 16 -0.182103494558E+04 -0.58308E-04 -0.27659E-03 1892 0.426E-02 0.286E-01 DAV: 17 -0.182103485407E+04 0.91504E-04 -0.14496E-03 1868 0.286E-02 0.207E-01 DAV: 18 -0.182103475775E+04 0.96325E-04 -0.60180E-04 1780 0.189E-02 0.113E-01 DAV: 19 -0.182103476006E+04 -0.23070E-05 -0.12863E-04 1452 0.118E-02 0.637E-02 DAV: 20 -0.182103476853E+04 -0.84706E-05 -0.55739E-05 1100 0.736E-03 22 T= 133. E= -.16042516E+04 F= -.18210348E+04 E0= -.18209040E+04 EK= 0.54834E+01 SP= 0.12E+03 SK= 0.87E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.182297388438E+04 -0.19391E+01 -0.99217E+00 1612 0.468E+00 0.183E+00 DAV: 2 -0.182363904725E+04 -0.66516E+00 -0.29804E+00 1764 0.145E+00 0.134E+01 DAV: 3 -0.182323198723E+04 0.40706E+00 -0.15237E+00 1820 0.670E-01 0.130E+01 DAV: 4 -0.182306713835E+04 0.16485E+00 -0.14880E+00 1956 0.459E-01 0.505E+00 DAV: 5 -0.182309057505E+04 -0.23437E-01 -0.53482E-01 1732 0.311E-01 0.487E+00 DAV: 6 -0.182306673757E+04 0.23837E-01 -0.35823E-01 1908 0.284E-01 0.304E+00 DAV: 7 -0.182306136707E+04 0.53705E-02 -0.22474E-01 1788 0.215E-01 0.292E+00 DAV: 8 -0.182305373533E+04 0.76317E-02 -0.13309E-01 1900 0.173E-01 0.204E+00 DAV: 9 -0.182305845434E+04 -0.47190E-02 -0.11601E-01 1868 0.176E-01 0.181E+00 DAV: 10 -0.182305604487E+04 0.24095E-02 -0.11254E-01 1860 0.176E-01 0.153E+00 DAV: 11 -0.182305279279E+04 0.32521E-02 -0.81252E-02 2020 0.166E-01 0.110E+00 DAV: 12 -0.182305108788E+04 0.17049E-02 -0.25707E-02 1900 0.130E-01 0.919E-01 DAV: 13 -0.182305115246E+04 -0.64585E-04 -0.96435E-03 1788 0.771E-02 0.687E-01 DAV: 14 -0.182305068659E+04 0.46588E-03 -0.69034E-03 1932 0.523E-02 0.569E-01 DAV: 15 -0.182305069151E+04 -0.49220E-05 -0.52825E-03 1916 0.452E-02 0.503E-01 DAV: 16 -0.182305026717E+04 0.42434E-03 -0.28265E-03 1724 0.382E-02 0.262E-01 DAV: 17 -0.182305035342E+04 -0.86253E-04 -0.10239E-03 1748 0.247E-02 0.172E-01 DAV: 18 -0.182305031166E+04 0.41762E-04 -0.47777E-04 1676 0.169E-02 0.102E-01 DAV: 19 -0.182305033043E+04 -0.18770E-04 -0.20396E-04 1340 0.119E-02 0.683E-02 DAV: 20 -0.182305031726E+04 0.13174E-04 -0.75785E-05 1156 0.817E-03 0.230E-02 DAV: 21 -0.182305032333E+04 -0.60751E-05 -0.17129E-05 860 0.459E-03 23 T= 122. E= -.16029785E+04 F= -.18230503E+04 E0= -.18229218E+04 EK= 0.50663E+01 SP= 0.13E+03 SK= 0.83E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.183055204593E+04 -0.75017E+01 -0.14467E+02 1506 0.137E+01 0.243E+01 DAV: 2 -0.185593430954E+04 -0.25382E+02 -0.63933E+01 2420 0.937E+00 0.404E+01 DAV: 3 -0.185183879450E+04 0.40955E+01 -0.61244E+01 1964 0.704E+00 0.348E+01 DAV: 4 -0.183717765878E+04 0.14661E+02 -0.33811E+01 2228 0.636E+00 0.248E+01 DAV: 5 -0.183240872318E+04 0.47689E+01 -0.15732E+01 1780 0.364E+00 0.194E+01 DAV: 6 -0.183108016536E+04 0.13286E+01 -0.60798E+00 1812 0.202E+00 0.165E+01 DAV: 7 -0.182956452138E+04 0.15156E+01 -0.27427E+00 2028 0.174E+00 0.136E+01 DAV: 8 -0.182908348159E+04 0.48104E+00 -0.32769E+00 1828 0.130E+00 0.171E+01 DAV: 9 -0.182852933418E+04 0.55415E+00 -0.34622E+00 1852 0.935E-01 0.131E+01 DAV: 10 -0.182774052876E+04 0.78881E+00 -0.19648E+00 2036 0.103E+00 0.824E+00 DAV: 11 -0.182752934885E+04 0.21118E+00 -0.10405E+00 1772 0.736E-01 0.890E+00 DAV: 12 -0.182728201738E+04 0.24733E+00 -0.75644E-01 1988 0.527E-01 0.649E+00 DAV: 13 -0.182713388977E+04 0.14813E+00 -0.10178E+00 2188 0.640E-01 0.926E+00 DAV: 14 -0.182679818098E+04 0.33571E+00 -0.58452E-01 2020 0.642E-01 0.721E+00 DAV: 15 -0.182655402718E+04 0.24415E+00 -0.57937E-01 2020 0.625E-01 0.437E+00 DAV: 16 -0.182643267325E+04 0.12135E+00 -0.47415E-01 1932 0.584E-01 0.495E+00 DAV: 17 -0.182626605802E+04 0.16662E+00 -0.73999E-01 2132 0.729E-01 0.527E+00 DAV: 18 -0.182630222139E+04 -0.36163E-01 -0.72916E-01 1932 0.672E-01 0.913E+00 DAV: 19 -0.182619879700E+04 0.10342E+00 -0.52650E-01 1772 0.376E-01 0.316E+00 DAV: 20 -0.182618252831E+04 0.16269E-01 -0.11147E-01 1796 0.221E-01 0.133E+00 DAV: 21 -0.182618938355E+04 -0.68552E-02 -0.55340E-02 1756 0.182E-01 0.174E+00 DAV: 22 -0.182618683298E+04 0.25506E-02 -0.32142E-02 1820 0.137E-01 0.708E-01 DAV: 23 -0.182618894669E+04 -0.21137E-02 -0.17862E-02 1804 0.111E-01 0.659E-01 DAV: 24 -0.182618808712E+04 0.85957E-03 -0.76210E-03 1940 0.867E-02 0.525E-01