iterations/neb0_image04_iter4_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.426026001534E+04 0.42603E+04 -0.25408E+05 9008 0.103E+03
DAV: 2 -0.947530755431E+02 -0.43550E+04 -0.39510E+04 11056 0.249E+02
DAV: 3 -0.421090855226E+03 -0.32634E+03 -0.30520E+03 10216 0.660E+01
DAV: 4 -0.429747367755E+03 -0.86565E+01 -0.85620E+01 10864 0.108E+01
DAV: 5 -0.430052554201E+03 -0.30519E+00 -0.30437E+00 11312 0.194E+00 0.106E+02
RMM: 6 -0.381919887199E+03 0.48133E+02 -0.10940E+02 9708 0.145E+01 0.776E+01
RMM: 7 -0.956170940620E+03 -0.57425E+03 -0.64551E+02 12009 0.224E+01 0.168E+02
RMM: 8 -0.503484453311E+03 0.45269E+03 -0.11531E+02 9887 0.116E+01 0.956E+01
RMM: 9 -0.445647534518E+03 0.57837E+02 -0.81918E+01 10238 0.115E+01 0.726E+01
RMM: 10 -0.372939327562E+03 0.72708E+02 -0.41726E+01 10270 0.833E+00 0.324E+01
RMM: 11 -0.366463133436E+03 0.64762E+01 -0.19807E+01 10285 0.517E+00 0.298E+01
RMM: 12 -0.366568112032E+03 -0.10498E+00 -0.65522E+00 10277 0.315E+00 0.294E+01
RMM: 13 -0.366299136927E+03 0.26898E+00 -0.37327E+00 10247 0.261E+00 0.197E+01
RMM: 14 -0.365560354964E+03 0.73878E+00 -0.15899E+00 10261 0.151E+00 0.142E+01
RMM: 15 -0.369864503831E+03 -0.43041E+01 -0.11990E+00 10428 0.144E+00 0.125E+01
RMM: 16 -0.376021992529E+03 -0.61575E+01 -0.17619E+00 11175 0.163E+00 0.193E+01
RMM: 17 -0.377035409247E+03 -0.10134E+01 -0.12558E+00 10793 0.143E+00 0.141E+01
RMM: 18 -0.382422601252E+03 -0.53872E+01 -0.12118E+00 11133 0.127E+00 0.123E+01
RMM: 19 -0.385371121363E+03 -0.29485E+01 -0.62928E-01 10847 0.954E-01 0.102E+01
RMM: 20 -0.390314854920E+03 -0.49437E+01 -0.13453E+00 11866 0.126E+00 0.860E+00
RMM: 21 -0.391893580074E+03 -0.15787E+01 -0.23270E-01 10582 0.568E-01 0.865E+00
RMM: 22 -0.393177871592E+03 -0.12843E+01 -0.32738E-01 11187 0.591E-01 0.800E+00
RMM: 23 -0.395868221522E+03 -0.26903E+01 -0.11238E+00 12836 0.989E-01 0.666E+00
RMM: 24 -0.398819311169E+03 -0.29511E+01 -0.89492E-01 12899 0.887E-01 0.573E+00
RMM: 25 -0.401289427669E+03 -0.24701E+01 -0.39642E-01 11915 0.610E-01 0.701E+00
RMM: 26 -0.401548270885E+03 -0.25884E+00 -0.72332E-02 10645 0.327E-01 0.631E+00
RMM: 27 -0.402290275482E+03 -0.74200E+00 -0.12527E-01 11527 0.352E-01 0.596E+00
RMM: 28 -0.402798892505E+03 -0.50862E+00 -0.62248E-02 11167 0.247E-01 0.585E+00
RMM: 29 -0.402236946456E+03 0.56195E+00 -0.52339E-02 10960 0.267E-01 0.566E+00
RMM: 30 -0.401548073205E+03 0.68887E+00 -0.24501E-01 13686 0.579E-01 0.540E+00
RMM: 31 -0.401044984408E+03 0.50309E+00 -0.11492E-01 12626 0.416E-01 0.562E+00
RMM: 32 -0.401224121429E+03 -0.17914E+00 -0.68498E-03 10155 0.115E-01 0.560E+00
RMM: 33 -0.403040969820E+03 -0.18168E+01 -0.83393E-01 16294 0.947E-01 0.650E+00
RMM: 34 -0.404297114183E+03 -0.12561E+01 -0.45047E-01 15757 0.683E-01 0.568E+00
RMM: 35 -0.405788650498E+03 -0.14915E+01 -0.49049E-01 16134 0.709E-01 0.588E+00
RMM: 36 -0.406005440025E+03 -0.21679E+00 -0.48257E-02 12837 0.267E-01 0.548E+00
RMM: 37 -0.406314138894E+03 -0.30870E+00 -0.46374E-02 12541 0.272E-01 0.471E+00
RMM: 38 -0.407188345918E+03 -0.87421E+00 -0.15294E-01 14431 0.396E-01 0.378E+00
RMM: 39 -0.407547648473E+03 -0.35930E+00 -0.56564E-02 12871 0.255E-01 0.338E+00
RMM: 40 -0.407800680700E+03 -0.25303E+00 -0.14748E-02 11032 0.143E-01 0.321E+00
RMM: 41 -0.407961199170E+03 -0.16052E+00 -0.24877E-02 11841 0.171E-01 0.291E+00
RMM: 42 -0.408005902856E+03 -0.44704E-01 -0.13183E-02 11058 0.126E-01 0.248E+00
RMM: 43 -0.408135073766E+03 -0.12917E+00 -0.13957E-02 11345 0.116E-01 0.217E+00
RMM: 44 -0.408247717268E+03 -0.11264E+00 -0.99137E-03 11201 0.938E-02 0.194E+00
RMM: 45 -0.408384515147E+03 -0.13680E+00 -0.15270E-02 12213 0.112E-01 0.160E+00
RMM: 46 -0.408497145743E+03 -0.11263E+00 -0.20418E-02 12866 0.131E-01 0.106E+00
RMM: 47 -0.408888979727E+03 -0.39183E+00 -0.33388E-02 13845 0.161E-01 0.956E+00
RMM: 48 -0.408309595809E+03 0.57938E+00 -0.94409E-03 11140 0.182E-01 0.726E+00
RMM: 49 -0.408389004191E+03 -0.79408E-01 -0.21298E-03 10666 0.663E-02 0.676E+00
RMM: 50 -0.408541890512E+03 -0.15289E+00 -0.31787E-03 11298 0.605E-02 0.794E+00
RMM: 51 -0.408378222415E+03 0.16367E+00 -0.11201E-02 13405 0.116E-01 0.570E+00
RMM: 52 -0.408562540713E+03 -0.18432E+00 -0.69017E-03 12137 0.104E-01 0.550E+00
RMM: 53 -0.408890458306E+03 -0.32792E+00 -0.48950E-02 15512 0.206E-01 0.508E+00
RMM: 54 -0.409084681214E+03 -0.19422E+00 -0.48057E-02 15089 0.199E-01 0.515E+00
RMM: 55 -0.409173309561E+03 -0.88628E-01 -0.30883E-02 14269 0.161E-01 0.556E+00
RMM: 56 -0.409275266133E+03 -0.10196E+00 -0.28164E-02 14559 0.161E-01 0.616E+00
RMM: 57 -0.409205286871E+03 0.69979E-01 -0.59907E-03 12439 0.757E-02 0.619E+00
RMM: 58 -0.409199764208E+03 0.55227E-02 -0.13645E-03 11075 0.375E-02 0.615E+00
RMM: 59 -0.409188722481E+03 0.11042E-01 -0.27802E-03 12163 0.448E-02 0.608E+00
RMM: 60 -0.409153920544E+03 0.34802E-01 -0.60992E-03 13433 0.640E-02 0.572E+00
RMM: 61 -0.409086947476E+03 0.66973E-01 -0.85035E-03 14325 0.726E-02 0.537E+00
RMM: 62 -0.409017843172E+03 0.69104E-01 -0.90454E-03 14369 0.748E-02 0.532E+00
RMM: 63 -0.408954230707E+03 0.63612E-01 -0.13440E-02 15064 0.847E-02 0.497E+00
RMM: 64 -0.408902333409E+03 0.51897E-01 -0.58524E-03 13775 0.566E-02 0.485E+00
RMM: 65 -0.408853401322E+03 0.48932E-01 -0.46173E-03 13413 0.501E-02 0.467E+00
RMM: 66 -0.408794463813E+03 0.58938E-01 -0.94570E-03 14772 0.712E-02 0.430E+00
RMM: 67 -0.408756792199E+03 0.37672E-01 -0.42161E-03 13463 0.489E-02 0.403E+00
RMM: 68 -0.408763176471E+03 -0.63843E-02 -0.43104E-04 10375 0.236E-02 0.413E+00
RMM: 69 -0.408765913456E+03 -0.27370E-02 -0.17535E-04 9807 0.158E-02 0.407E+00
RMM: 70 -0.408757025442E+03 0.88880E-02 -0.22365E-04 10639 0.136E-02 0.402E+00
RMM: 71 -0.408757969829E+03 -0.94439E-03 -0.17113E-03 13403 0.378E-02 0.376E+00
RMM: 72 -0.408752073569E+03 0.58963E-02 -0.20488E-04 10544 0.184E-02 0.373E+00
RMM: 73 -0.408743338347E+03 0.87352E-02 -0.15758E-04 9275 0.182E-02 0.376E+00
RMM: 74 -0.408770222064E+03 -0.26884E-01 -0.22869E-03 13097 0.425E-02 0.482E+00
RMM: 75 -0.408649001210E+03 0.12122E+00 -0.58265E-03 15095 0.108E-01 0.438E+00
RMM: 76 -0.408688628228E+03 -0.39627E-01 -0.29501E-03 15492 0.400E-02 0.363E+00
RMM: 77 -0.408792035550E+03 -0.10341E+00 -0.68484E-03 15754 0.107E-01 0.433E+00
RMM: 78 -0.408740463728E+03 0.51572E-01 -0.31885E-03 13680 0.819E-02 0.491E+00
RMM: 79 -0.408624530507E+03 0.11593E+00 -0.49673E-03 15149 0.875E-02 0.465E+00
RMM: 80 -0.408624450516E+03 0.79991E-04 -0.15756E-05 7197 0.464E-03 0.464E+00
RMM: 81 -0.408611397798E+03 0.13053E-01 -0.44539E-04 11080 0.183E-02 0.347E+00
RMM: 82 -0.408788628474E+03 -0.17723E+00 -0.87380E-03 15902 0.116E-01 0.337E+00
RMM: 83 -0.408818079897E+03 -0.29451E-01 -0.87039E-04 11645 0.453E-02 0.340E+00
RMM: 84 -0.408822714419E+03 -0.46345E-02 -0.26266E-04 9269 0.217E-02 0.354E+00
RMM: 85 -0.408850399440E+03 -0.27685E-01 -0.13509E-03 12874 0.374E-02 0.345E+00
RMM: 86 -0.408904615665E+03 -0.54216E-01 -0.32011E-03 13848 0.477E-02 0.465E+00
RMM: 87 -0.408786717363E+03 0.11790E+00 -0.66039E-03 15816 0.106E-01 0.340E+00
RMM: 88 -0.408897133679E+03 -0.11042E+00 -0.45956E-03 15525 0.774E-02 0.265E+00
RMM: 89 -0.408995421291E+03 -0.98288E-01 -0.40890E-03 15368 0.855E-02 0.251E+00
RMM: 90 -0.409026528242E+03 -0.31107E-01 -0.15532E-03 13233 0.429E-02 0.234E+00
RMM: 91 -0.409271856043E+03 -0.24533E+00 -0.11512E-01 17631 0.291E-01 0.318E+00
RMM: 92 -0.409275629092E+03 -0.37730E-02 -0.46510E-03 14150 0.127E-01 0.319E+00
RMM: 93 -0.409260171500E+03 0.15458E-01 -0.33972E-04 10256 0.324E-02 0.319E+00
RMM: 94 -0.409246563254E+03 0.13608E-01 -0.24106E-04 10220 0.177E-02 0.320E+00
RMM: 95 -0.409250508401E+03 -0.39451E-02 -0.18230E-04 9804 0.159E-02 0.317E+00
RMM: 96 -0.409323539379E+03 -0.73031E-01 -0.42629E-03 15846 0.518E-02 0.318E+00
RMM: 97 -0.409344205591E+03 -0.20666E-01 -0.14359E-03 14626 0.295E-02 0.329E+00
RMM: 98 -0.409404393999E+03 -0.60188E-01 -0.68665E-03 16812 0.611E-02 0.354E+00
RMM: 99 -0.409427765967E+03 -0.23372E-01 -0.12943E-03 14797 0.288E-02 0.360E+00
RMM: 100 -0.409439523318E+03 -0.11757E-01 -0.83675E-04 12991 0.252E-02 0.357E+00
RMM: 101 -0.409429278263E+03 0.10245E-01 -0.18249E-03 14340 0.337E-02 0.340E+00
RMM: 102 -0.409408324686E+03 0.20954E-01 -0.23842E-03 15098 0.352E-02 0.322E+00
RMM: 103 -0.409393262454E+03 0.15062E-01 -0.13135E-03 14010 0.263E-02 0.308E+00
RMM: 104 -0.409382832424E+03 0.10430E-01 -0.76874E-04 12848 0.207E-02 0.298E+00
RMM: 105 -0.409374689706E+03 0.81427E-02 -0.48408E-04 11765 0.164E-02 0.290E+00
RMM: 106 -0.409366241917E+03 0.84478E-02 -0.42861E-04 11425 0.153E-02 0.282E+00
RMM: 107 -0.409354872553E+03 0.11369E-01 -0.63671E-04 12429 0.183E-02 0.272E+00
RMM: 108 -0.409348852834E+03 0.60197E-02 -0.20957E-04 10226 0.108E-02 0.267E+00
RMM: 109 -0.409348606500E+03 0.24633E-03 -0.57018E-06 6429 0.300E-03 0.267E+00
RMM: 110 -0.409347098397E+03 0.15081E-02 -0.13077E-05 6417 0.316E-03 0.266E+00
RMM: 111 -0.409354653248E+03 -0.75549E-02 -0.31412E-04 10115 0.128E-02 0.273E+00
RMM: 112 -0.409349898213E+03 0.47550E-02 -0.12497E-04 8131 0.873E-03 0.268E+00
RMM: 113 -0.409348108466E+03 0.17897E-02 -0.15783E-05 6751 0.382E-03 0.267E+00
RMM: 114 -0.409350085055E+03 -0.19766E-02 -0.15249E-05 6639 0.376E-03 0.269E+00
RMM: 115 -0.409352186720E+03 -0.21017E-02 -0.24886E-05 6534 0.379E-03 0.270E+00
RMM: 116 -0.409338543996E+03 0.13643E-01 -0.58277E-04 11877 0.185E-02 0.262E+00
RMM: 117 -0.409337407581E+03 0.11364E-02 -0.23629E-05 7406 0.472E-03 0.261E+00
RMM: 118 -0.409335006100E+03 0.24015E-02 -0.39932E-05 7543 0.501E-03 0.259E+00
RMM: 119 -0.409330727951E+03 0.42781E-02 -0.10681E-04 8887 0.770E-03 0.255E+00
RMM: 120 -0.409325653469E+03 0.50745E-02 -0.16476E-04 9638 0.948E-03 0.250E+00
RMM: 121 -0.409299185255E+03 0.26468E-01 -0.37154E-03 15839 0.438E-02 0.224E+00
RMM: 122 -0.409290243956E+03 0.89413E-02 -0.84477E-04 13308 0.211E-02 0.212E+00
RMM: 123 -0.409284197349E+03 0.60466E-02 -0.44326E-04 11727 0.155E-02 0.203E+00
RMM: 124 -0.409278442311E+03 0.57550E-02 -0.51937E-04 12041 0.172E-02 0.192E+00
RMM: 125 -0.409272661755E+03 0.57806E-02 -0.91985E-04 13209 0.229E-02 0.177E+00
RMM: 126 -0.409256796410E+03 0.15865E-01 -0.29313E-03 15596 0.396E-02 0.150E+00
RMM: 127 -0.409255037613E+03 0.17588E-02 -0.61522E-04 12764 0.205E-02 0.138E+00
RMM: 128 -0.409254231784E+03 0.80583E-03 -0.25411E-04 10755 0.138E-02 0.130E+00
RMM: 129 -0.409249513662E+03 0.47181E-02 -0.79981E-04 13002 0.216E-02 0.117E+00
RMM: 130 -0.409248319796E+03 0.11939E-02 -0.99496E-05 8885 0.878E-03 0.109E+00
RMM: 131 -0.409546959060E+03 -0.29864E+00 -0.39496E-02 17743 0.149E-01 0.977E+00
RMM: 132 -0.409701753766E+03 -0.15479E+00 -0.42970E-02 17523 0.238E-01 0.102E+01
RMM: 133 -0.409524804315E+03 0.17695E+00 -0.20875E-03 14506 0.473E-02 0.991E+00
RMM: 134 -0.409396034965E+03 0.12877E+00 -0.72202E-03 16224 0.657E-02 0.573E+00
RMM: 135 -0.410606182162E+03 -0.12101E+01 -0.19455E-01 17873 0.339E-01 0.120E+01
RMM: 136 -0.409112088860E+03 0.14941E+01 -0.40282E-01 17909 0.476E-01 0.347E+00
RMM: 137 -0.409423004495E+03 -0.31092E+00 -0.21516E-02 17015 0.172E-01 0.535E+00
RMM: 138 -0.409463494542E+03 -0.40490E-01 -0.25620E-03 14842 0.730E-02 0.549E+00
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RMM: 140 -0.409420973707E+03 0.92632E-03 -0.98078E-06 6925 0.442E-03 0.544E+00
RMM: 141 -0.409444147460E+03 -0.23174E-01 -0.55679E-04 11438 0.186E-02 0.558E+00
RMM: 142 -0.409441821906E+03 0.23256E-02 -0.28446E-05 7137 0.596E-03 0.559E+00
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RMM: 146 -0.409461746588E+03 0.11636E-01 -0.60643E-05 8090 0.661E-03 0.560E+00
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RMM: 149 -0.409467846100E+03 0.95460E-02 -0.64364E-05 7432 0.660E-03 0.560E+00
RMM: 150 -0.409438414732E+03 0.29431E-01 -0.62261E-04 12133 0.192E-02 0.547E+00
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RMM: 153 -0.409269268033E+03 -0.16797E-02 -0.21357E-03 13519 0.887E-02 0.201E+00
RMM: 154 -0.409257964969E+03 0.11303E-01 -0.45148E-04 11577 0.315E-02 0.202E+00
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RMM: 156 -0.409223010820E+03 0.26508E-01 -0.21405E-03 12902 0.434E-02 0.238E+00
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RMM: 158 -0.409210049484E+03 0.12577E-01 -0.41838E-04 9615 0.188E-02 0.258E+00
RMM: 159 -0.409214427420E+03 -0.43779E-02 -0.24148E-05 6677 0.619E-03 0.255E+00
RMM: 160 -0.409216232806E+03 -0.18054E-02 -0.10848E-03 12500 0.255E-02 0.237E+00
RMM: 161 -0.409196701632E+03 0.19531E-01 -0.83762E-04 11918 0.251E-02 0.199E+00
RMM: 162 -0.409218508873E+03 -0.21807E-01 -0.82147E-04 11213 0.360E-02 0.215E+00
RMM: 163 -0.409227734314E+03 -0.92254E-02 -0.12487E-03 12324 0.304E-02 0.200E+00
RMM: 164 -0.409234961843E+03 -0.72275E-02 -0.14595E-03 12909 0.321E-02 0.176E+00
RMM: 165 -0.409253077721E+03 -0.18116E-01 -0.56479E-03 15048 0.679E-02 0.137E+00
RMM: 166 -0.409255170263E+03 -0.20925E-02 -0.49227E-03 15390 0.597E-02 0.986E-01
RMM: 167 -0.409256691512E+03 -0.15212E-02 -0.50261E-03 14893 0.635E-02 0.676E-01
RMM: 168 -0.409251086085E+03 0.56054E-02 -0.38809E-03 14372 0.548E-02 0.557E-01
RMM: 169 -0.409255617274E+03 -0.45312E-02 -0.27213E-03 13686 0.467E-02 0.269E+00
RMM: 170 -0.409249994501E+03 0.56228E-02 -0.83566E-03 15677 0.990E-02 0.238E+00
RMM: 171 -0.409303781807E+03 -0.53787E-01 -0.27697E-03 15060 0.483E-02 0.533E+00
RMM: 172 -0.409272128421E+03 0.31653E-01 -0.19796E-03 12834 0.761E-02 0.524E+00
RMM: 173 -0.409263017983E+03 0.91104E-02 -0.98066E-05 8583 0.169E-02 0.523E+00
RMM: 174 -0.409286920202E+03 -0.23902E-01 -0.91674E-04 11373 0.280E-02 0.511E+00
RMM: 175 -0.409261768858E+03 0.25151E-01 -0.88249E-04 12764 0.228E-02 0.495E+00
RMM: 176 -0.409270808800E+03 -0.90399E-02 -0.19573E-04 9909 0.143E-02 0.495E+00
RMM: 177 -0.409296033875E+03 -0.25225E-01 -0.26538E-03 13357 0.476E-02 0.474E+00
RMM: 178 -0.409258944408E+03 0.37089E-01 -0.61495E-04 12478 0.199E-02 0.466E+00
RMM: 179 -0.409252177212E+03 0.67672E-02 -0.42617E-05 7887 0.588E-03 0.464E+00
RMM: 180 -0.409251609514E+03 0.56770E-03 -0.12381E-05 6489 0.371E-03 0.462E+00
RMM: 181 -0.409203483788E+03 0.48126E-01 -0.14780E-03 13036 0.344E-02 0.412E+00
RMM: 182 -0.409207082374E+03 -0.35986E-02 -0.15187E-04 9042 0.174E-02 0.381E+00
RMM: 183 -0.409205508265E+03 0.15741E-02 -0.16377E-04 8857 0.152E-02 0.308E+00
RMM: 184 -0.409207630234E+03 -0.21220E-02 -0.54665E-04 11848 0.289E-02 0.153E+00
RMM: 185 -0.409235285799E+03 -0.27656E-01 -0.33582E-03 15659 0.626E-02 0.218E+00
RMM: 186 -0.409235745989E+03 -0.46019E-03 -0.49272E-03 15538 0.106E-01 0.244E+00
RMM: 187 -0.409238179810E+03 -0.24338E-02 -0.69774E-04 11340 0.330E-02 0.231E+00
RMM: 188 -0.409235549519E+03 0.26303E-02 -0.57238E-05 8080 0.100E-02 0.230E+00
RMM: 189 -0.409238215363E+03 -0.26658E-02 -0.11300E-03 12493 0.271E-02 0.210E+00
RMM: 190 -0.409248830338E+03 -0.10615E-01 -0.22761E-03 13621 0.418E-02 0.181E+00
RMM: 191 -0.409251227343E+03 -0.23970E-02 -0.74567E-04 11836 0.227E-02 0.165E+00
RMM: 192 -0.409254254614E+03 -0.30273E-02 -0.21030E-04 9193 0.134E-02 0.157E+00
RMM: 193 -0.409258638225E+03 -0.43836E-02 -0.45846E-04 10265 0.203E-02 0.145E+00
RMM: 194 -0.409258513501E+03 0.12472E-03 -0.13509E-04 8684 0.989E-03 0.139E+00
RMM: 195 -0.409255187859E+03 0.33256E-02 -0.72074E-05 8375 0.726E-03 0.137E+00
RMM: 196 -0.409257011402E+03 -0.18235E-02 -0.31671E-04 9912 0.169E-02 0.127E+00
RMM: 197 -0.409255176746E+03 0.18347E-02 -0.14086E-04 9275 0.944E-03 0.123E+00
RMM: 198 -0.409250922874E+03 0.42539E-02 -0.81778E-04 12960 0.220E-02 0.970E-01
RMM: 199 -0.409250557908E+03 0.36497E-03 -0.15336E-04 9737 0.127E-02 0.697E-01
RMM: 200 -0.409252053734E+03 -0.14958E-02 -0.78999E-05 8504 0.135E-02
1 F= -.44715002E+03 E0= -.44715014E+03 d E =0.367188E-03 mag= -0.0728