# BSE Version 0.11.dev17+g4fabcd53
# Data downloaded on 2024-11-21T16:45
# cc-pwCVQZ-DK version number 0 AutoAux 
# Role: JK Fitting 
# Stoychev GL, Auer AA, Neese F. 
# Automatic Generation of Auxiliary Basis Sets.
# J Chem Theory Comput. 2017 Feb 14;13(2):554-562.
# doi: 10.1021/acs.jctc.6b01041.
# 
basis "Sc_cc-pwCVQZ-DK-autoaux" SPHERICAL 
#basis SET: (20s,17p,16d,16f,16g,9h,5i,4k) -> [20s,17p,16d,16f,16g,9h,5i,4k]
Sc    S
      3.167653e+03           1.0
Sc    S
      1.759807e+03           1.0
Sc    S
      9.776708e+02           1.0
Sc    S
      5.431504e+02           1.0
Sc    S
      3.017502e+02           1.0
Sc    S
      1.676390e+02           1.0
Sc    S
      9.313279e+01           1.0
Sc    S
      5.174044e+01           1.0
Sc    S
      2.874469e+01           1.0
Sc    S
      1.596927e+01           1.0
Sc    S
      8.871818e+00           1.0
Sc    S
      4.928788e+00           1.0
Sc    S
      2.738215e+00           1.0
Sc    S
      1.521231e+00           1.0
Sc    S
      8.451282e-01           1.0
Sc    S
      4.695157e-01           1.0
Sc    S
      2.608420e-01           1.0
Sc    S
      1.449122e-01           1.0
Sc    S
      8.050680e-02           1.0
Sc    S
      4.472600e-02           1.0
Sc    P
      5.568124e+02           1.0
Sc    P
      3.093402e+02           1.0
Sc    P
      1.718557e+02           1.0
Sc    P
      9.547538e+01           1.0
Sc    P
      5.304188e+01           1.0
Sc    P
      2.946771e+01           1.0
Sc    P
      1.637095e+01           1.0
Sc    P
      9.094972e+00           1.0
Sc    P
      5.052762e+00           1.0
Sc    P
      2.807090e+00           1.0
Sc    P
      1.559494e+00           1.0
Sc    P
      8.663858e-01           1.0
Sc    P
      4.813255e-01           1.0
Sc    P
      2.674030e-01           1.0
Sc    P
      1.485572e-01           1.0
Sc    P
      8.253180e-02           1.0
Sc    P
      4.585100e-02           1.0
Sc    D
      3.072285e+02           1.0
Sc    D
      1.706825e+02           1.0
Sc    D
      9.482362e+01           1.0
Sc    D
      5.267979e+01           1.0
Sc    D
      2.926655e+01           1.0
Sc    D
      1.625919e+01           1.0
Sc    D
      9.032885e+00           1.0
Sc    D
      5.018270e+00           1.0
Sc    D
      2.787928e+00           1.0
Sc    D
      1.548849e+00           1.0
Sc    D
      8.604715e-01           1.0
Sc    D
      4.780397e-01           1.0
Sc    D
      2.655776e-01           1.0
Sc    D
      1.475431e-01           1.0
Sc    D
      8.196840e-02           1.0
Sc    D
      4.553800e-02           1.0
Sc    F
      3.127068e+02           1.0
Sc    F
      1.737260e+02           1.0
Sc    F
      9.651444e+01           1.0
Sc    F
      5.361913e+01           1.0
Sc    F
      2.978841e+01           1.0
Sc    F
      1.654912e+01           1.0
Sc    F
      9.193953e+00           1.0
Sc    F
      5.107752e+00           1.0
Sc    F
      2.837640e+00           1.0
Sc    F
      1.576467e+00           1.0
Sc    F
      8.758148e-01           1.0
Sc    F
      4.865638e-01           1.0
Sc    F
      2.703132e-01           1.0
Sc    F
      1.501740e-01           1.0
Sc    F
      8.343000e-02           1.0
Sc    F
      4.635000e-02           1.0
Sc    G
      3.127068e+02           1.0
Sc    G
      1.737260e+02           1.0
Sc    G
      9.651444e+01           1.0
Sc    G
      5.361913e+01           1.0
Sc    G
      2.978841e+01           1.0
Sc    G
      1.654912e+01           1.0
Sc    G
      9.193953e+00           1.0
Sc    G
      5.107752e+00           1.0
Sc    G
      2.837640e+00           1.0
Sc    G
      1.576467e+00           1.0
Sc    G
      8.758148e-01           1.0
Sc    G
      4.865638e-01           1.0
Sc    G
      2.703132e-01           1.0
Sc    G
      1.501740e-01           1.0
Sc    G
      8.343000e-02           1.0
Sc    G
      4.635000e-02           1.0
Sc    H
      1.047605e+02           1.0
Sc    H
      4.554805e+01           1.0
Sc    H
      1.980350e+01           1.0
Sc    H
      8.610218e+00           1.0
Sc    H
      3.743573e+00           1.0
Sc    H
      1.627640e+00           1.0
Sc    H
      7.076697e-01           1.0
Sc    H
      3.076825e-01           1.0
Sc    H
      1.337750e-01           1.0
Sc    I
      1.791720e+01           1.0
Sc    I
      5.972400e+00           1.0
Sc    I
      1.990800e+00           1.0
Sc    I
      6.636000e-01           1.0
Sc    I
      2.212000e-01           1.0
Sc    K
      9.817200e+00           1.0
Sc    K
      3.272400e+00           1.0
Sc    K
      1.090800e+00           1.0
Sc    K
      3.636000e-01           1.0
end
basis "Ti_cc-pwCVQZ-DK-autoaux" SPHERICAL 
#basis SET: (20s,18p,16d,16f,16g,9h,5i,4k) -> [20s,18p,16d,16f,16g,9h,5i,4k]
Ti    S
      3.404912e+03           1.0
Ti    S
      1.891618e+03           1.0
Ti    S
      1.050899e+03           1.0
Ti    S
      5.838327e+02           1.0
Ti    S
      3.243515e+02           1.0
Ti    S
      1.801953e+02           1.0
Ti    S
      1.001085e+02           1.0
Ti    S
      5.561583e+01           1.0
Ti    S
      3.089768e+01           1.0
Ti    S
      1.716538e+01           1.0
Ti    S
      9.536321e+00           1.0
Ti    S
      5.297956e+00           1.0
Ti    S
      2.943309e+00           1.0
Ti    S
      1.635172e+00           1.0
Ti    S
      9.084287e-01           1.0
Ti    S
      5.046826e-01           1.0
Ti    S
      2.803792e-01           1.0
Ti    S
      1.557662e-01           1.0
Ti    S
      8.653680e-02           1.0
Ti    S
      4.807600e-02           1.0
Ti    P
      1.090092e+03           1.0
Ti    P
      6.056068e+02           1.0
Ti    P
      3.364482e+02           1.0
Ti    P
      1.869157e+02           1.0
Ti    P
      1.038420e+02           1.0
Ti    P
      5.769002e+01           1.0
Ti    P
      3.205001e+01           1.0
Ti    P
      1.780556e+01           1.0
Ti    P
      9.891979e+00           1.0
Ti    P
      5.495544e+00           1.0
Ti    P
      3.053080e+00           1.0
Ti    P
      1.696156e+00           1.0
Ti    P
      9.423087e-01           1.0
Ti    P
      5.235048e-01           1.0
Ti    P
      2.908360e-01           1.0
Ti    P
      1.615756e-01           1.0
Ti    P
      8.976420e-02           1.0
Ti    P
      4.986900e-02           1.0
Ti    D
      3.485449e+02           1.0
Ti    D
      1.936361e+02           1.0
Ti    D
      1.075756e+02           1.0
Ti    D
      5.976422e+01           1.0
Ti    D
      3.320235e+01           1.0
Ti    D
      1.844575e+01           1.0
Ti    D
      1.024764e+01           1.0
Ti    D
      5.693132e+00           1.0
Ti    D
      3.162851e+00           1.0
Ti    D
      1.757140e+00           1.0
Ti    D
      9.761886e-01           1.0
Ti    D
      5.423270e-01           1.0
Ti    D
      3.012928e-01           1.0
Ti    D
      1.673849e-01           1.0
Ti    D
      9.299160e-02           1.0
Ti    D
      5.166200e-02           1.0
Ti    F
      3.917369e+02           1.0
Ti    F
      2.176316e+02           1.0
Ti    F
      1.209065e+02           1.0
Ti    F
      6.717026e+01           1.0
Ti    F
      3.731681e+01           1.0
Ti    F
      2.073156e+01           1.0
Ti    F
      1.151753e+01           1.0
Ti    F
      6.398630e+00           1.0
Ti    F
      3.554794e+00           1.0
Ti    F
      1.974886e+00           1.0
Ti    F
      1.097159e+00           1.0
Ti    F
      6.095326e-01           1.0
Ti    F
      3.386292e-01           1.0
Ti    F
      1.881274e-01           1.0
Ti    F
      1.045152e-01           1.0
Ti    F
      5.806400e-02           1.0
Ti    G
      4.349289e+02           1.0
Ti    G
      2.416272e+02           1.0
Ti    G
      1.342373e+02           1.0
Ti    G
      7.457629e+01           1.0
Ti    G
      4.143127e+01           1.0
Ti    G
      2.301737e+01           1.0
Ti    G
      1.278743e+01           1.0
Ti    G
      7.104128e+00           1.0
Ti    G
      3.946738e+00           1.0
Ti    G
      2.192632e+00           1.0
Ti    G
      1.218129e+00           1.0
Ti    G
      6.767383e-01           1.0
Ti    G
      3.759657e-01           1.0
Ti    G
      2.088698e-01           1.0
Ti    G
      1.160388e-01           1.0
Ti    G
      6.446600e-02           1.0
Ti    H
      1.658885e+02           1.0
Ti    H
      7.212544e+01           1.0
Ti    H
      3.135889e+01           1.0
Ti    H
      1.363430e+01           1.0
Ti    H
      5.927956e+00           1.0
Ti    H
      2.577372e+00           1.0
Ti    H
      1.120597e+00           1.0
Ti    H
      4.872159e-01           1.0
Ti    H
      2.118330e-01           1.0
Ti    I
      2.909520e+01           1.0
Ti    I
      9.698400e+00           1.0
Ti    I
      3.232800e+00           1.0
Ti    I
      1.077600e+00           1.0
Ti    I
      3.592000e-01           1.0
Ti    K
      1.550610e+01           1.0
Ti    K
      5.168700e+00           1.0
Ti    K
      1.722900e+00           1.0
Ti    K
      5.743000e-01           1.0
end
basis "V_cc-pwCVQZ-DK-autoaux" SPHERICAL 
#basis SET: (20s,18p,16d,16f,16g,8h,5i,4k) -> [20s,18p,16d,16f,16g,8h,5i,4k]
V    S
      3.634805e+03           1.0
V    S
      2.019336e+03           1.0
V    S
      1.121854e+03           1.0
V    S
      6.232520e+02           1.0
V    S
      3.462511e+02           1.0
V    S
      1.923617e+02           1.0
V    S
      1.068676e+02           1.0
V    S
      5.937090e+01           1.0
V    S
      3.298383e+01           1.0
V    S
      1.832435e+01           1.0
V    S
      1.018020e+01           1.0
V    S
      5.655664e+00           1.0
V    S
      3.142036e+00           1.0
V    S
      1.745575e+00           1.0
V    S
      9.697641e-01           1.0
V    S
      5.387578e-01           1.0
V    S
      2.993099e-01           1.0
V    S
      1.662833e-01           1.0
V    S
      9.237960e-02           1.0
V    S
      5.132200e-02           1.0
V    P
      1.169572e+03           1.0
V    P
      6.497622e+02           1.0
V    P
      3.609790e+02           1.0
V    P
      2.005439e+02           1.0
V    P
      1.114133e+02           1.0
V    P
      6.189626e+01           1.0
V    P
      3.438681e+01           1.0
V    P
      1.910378e+01           1.0
V    P
      1.061321e+01           1.0
V    P
      5.896230e+00           1.0
V    P
      3.275683e+00           1.0
V    P
      1.819824e+00           1.0
V    P
      1.011013e+00           1.0
V    P
      5.616741e-01           1.0
V    P
      3.120412e-01           1.0
V    P
      1.733562e-01           1.0
V    P
      9.630900e-02           1.0
V    P
      5.350500e-02           1.0
V    D
      3.757069e+02           1.0
V    D
      2.087261e+02           1.0
V    D
      1.159589e+02           1.0
V    D
      6.442163e+01           1.0
V    D
      3.578979e+01           1.0
V    D
      1.988322e+01           1.0
V    D
      1.104623e+01           1.0
V    D
      6.136796e+00           1.0
V    D
      3.409331e+00           1.0
V    D
      1.894073e+00           1.0
V    D
      1.052263e+00           1.0
V    D
      5.845903e-01           1.0
V    D
      3.247724e-01           1.0
V    D
      1.804291e-01           1.0
V    D
      1.002384e-01           1.0
V    D
      5.568800e-02           1.0
V    F
      4.654440e+02           1.0
V    F
      2.585800e+02           1.0
V    F
      1.436556e+02           1.0
V    F
      7.980864e+01           1.0
V    F
      4.433813e+01           1.0
V    F
      2.463230e+01           1.0
V    F
      1.368461e+01           1.0
V    F
      7.602561e+00           1.0
V    F
      4.223645e+00           1.0
V    F
      2.346469e+00           1.0
V    F
      1.303594e+00           1.0
V    F
      7.242189e-01           1.0
V    F
      4.023438e-01           1.0
V    F
      2.235244e-01           1.0
V    F
      1.241802e-01           1.0
V    F
      6.898900e-02           1.0
V    G
      5.551811e+02           1.0
V    G
      3.084339e+02           1.0
V    G
      1.713522e+02           1.0
V    G
      9.519565e+01           1.0
V    G
      5.288647e+01           1.0
V    G
      2.938137e+01           1.0
V    G
      1.632299e+01           1.0
V    G
      9.068326e+00           1.0
V    G
      5.037959e+00           1.0
V    G
      2.798866e+00           1.0
V    G
      1.554926e+00           1.0
V    G
      8.638475e-01           1.0
V    G
      4.799153e-01           1.0
V    G
      2.666196e-01           1.0
V    G
      1.481220e-01           1.0
V    G
      8.229000e-02           1.0
V    H
      9.967456e+01           1.0
V    H
      4.333677e+01           1.0
V    H
      1.884207e+01           1.0
V    H
      8.192205e+00           1.0
V    H
      3.561828e+00           1.0
V    H
      1.548621e+00           1.0
V    H
      6.733135e-01           1.0
V    H
      2.927450e-01           1.0
V    I
      4.075920e+01           1.0
V    I
      1.358640e+01           1.0
V    I
      4.528800e+00           1.0
V    I
      1.509600e+00           1.0
V    I
      5.032000e-01           1.0
V    K
      2.181600e+01           1.0
V    K
      7.272000e+00           1.0
V    K
      2.424000e+00           1.0
V    K
      8.080000e-01           1.0
end
basis "Cr_cc-pwCVQZ-DK-autoaux" SPHERICAL 
#basis SET: (21s,18p,16d,16f,16g,8h,5i,4k) -> [21s,18p,16d,16f,16g,8h,5i,4k]
Cr    S
      6.567891e+03           1.0
Cr    S
      3.648828e+03           1.0
Cr    S
      2.027127e+03           1.0
Cr    S
      1.126182e+03           1.0
Cr    S
      6.256565e+02           1.0
Cr    S
      3.475869e+02           1.0
Cr    S
      1.931038e+02           1.0
Cr    S
      1.072799e+02           1.0
Cr    S
      5.959995e+01           1.0
Cr    S
      3.311108e+01           1.0
Cr    S
      1.839505e+01           1.0
Cr    S
      1.021947e+01           1.0
Cr    S
      5.677484e+00           1.0
Cr    S
      3.154158e+00           1.0
Cr    S
      1.752310e+00           1.0
Cr    S
      9.735054e-01           1.0
Cr    S
      5.408364e-01           1.0
Cr    S
      3.004646e-01           1.0
Cr    S
      1.669248e-01           1.0
Cr    S
      9.273600e-02           1.0
Cr    S
      5.152000e-02           1.0
Cr    P
      1.217815e+03           1.0
Cr    P
      6.765639e+02           1.0
Cr    P
      3.758688e+02           1.0
Cr    P
      2.088160e+02           1.0
Cr    P
      1.160089e+02           1.0
Cr    P
      6.444939e+01           1.0
Cr    P
      3.580522e+01           1.0
Cr    P
      1.989179e+01           1.0
Cr    P
      1.105099e+01           1.0
Cr    P
      6.139440e+00           1.0
Cr    P
      3.410800e+00           1.0
Cr    P
      1.894889e+00           1.0
Cr    P
      1.052716e+00           1.0
Cr    P
      5.848423e-01           1.0
Cr    P
      3.249124e-01           1.0
Cr    P
      1.805069e-01           1.0
Cr    P
      1.002816e-01           1.0
Cr    P
      5.571200e-02           1.0
Cr    D
      4.041508e+02           1.0
Cr    D
      2.245282e+02           1.0
Cr    D
      1.247379e+02           1.0
Cr    D
      6.929883e+01           1.0
Cr    D
      3.849935e+01           1.0
Cr    D
      2.138853e+01           1.0
Cr    D
      1.188251e+01           1.0
Cr    D
      6.601397e+00           1.0
Cr    D
      3.667443e+00           1.0
Cr    D
      2.037468e+00           1.0
Cr    D
      1.131927e+00           1.0
Cr    D
      6.288482e-01           1.0
Cr    D
      3.493601e-01           1.0
Cr    D
      1.940890e-01           1.0
Cr    D
      1.078272e-01           1.0
Cr    D
      5.990400e-02           1.0
Cr    F
      5.139658e+02           1.0
Cr    F
      2.855366e+02           1.0
Cr    F
      1.586314e+02           1.0
Cr    F
      8.812857e+01           1.0
Cr    F
      4.896032e+01           1.0
Cr    F
      2.720018e+01           1.0
Cr    F
      1.511121e+01           1.0
Cr    F
      8.395116e+00           1.0
Cr    F
      4.663953e+00           1.0
Cr    F
      2.591085e+00           1.0
Cr    F
      1.439492e+00           1.0
Cr    F
      7.997177e-01           1.0
Cr    F
      4.442876e-01           1.0
Cr    F
      2.468264e-01           1.0
Cr    F
      1.371258e-01           1.0
Cr    F
      7.618100e-02           1.0
Cr    G
      6.237809e+02           1.0
Cr    G
      3.465449e+02           1.0
Cr    G
      1.925250e+02           1.0
Cr    G
      1.069583e+02           1.0
Cr    G
      5.942129e+01           1.0
Cr    G
      3.301183e+01           1.0
Cr    G
      1.833990e+01           1.0
Cr    G
      1.018884e+01           1.0
Cr    G
      5.660464e+00           1.0
Cr    G
      3.144702e+00           1.0
Cr    G
      1.747057e+00           1.0
Cr    G
      9.705871e-01           1.0
Cr    G
      5.392151e-01           1.0
Cr    G
      2.995639e-01           1.0
Cr    G
      1.664244e-01           1.0
Cr    G
      9.245800e-02           1.0
Cr    H
      1.227198e+02           1.0
Cr    H
      5.335643e+01           1.0
Cr    H
      2.319845e+01           1.0
Cr    H
      1.008628e+01           1.0
Cr    H
      4.385340e+00           1.0
Cr    H
      1.906669e+00           1.0
Cr    H
      8.289867e-01           1.0
Cr    H
      3.604290e-01           1.0
Cr    I
      5.090040e+01           1.0
Cr    I
      1.696680e+01           1.0
Cr    I
      5.655600e+00           1.0
Cr    I
      1.885200e+00           1.0
Cr    I
      6.284000e-01           1.0
Cr    K
      2.697300e+01           1.0
Cr    K
      8.991000e+00           1.0
Cr    K
      2.997000e+00           1.0
Cr    K
      9.990000e-01           1.0
end
basis "Mn_cc-pwCVQZ-DK-autoaux" SPHERICAL 
#basis SET: (21s,18p,17d,16f,16g,8h,5i,4k) -> [21s,18p,17d,16f,16g,8h,5i,4k]
Mn    S
      7.271849e+03           1.0
Mn    S
      4.039916e+03           1.0
Mn    S
      2.244398e+03           1.0
Mn    S
      1.246888e+03           1.0
Mn    S
      6.927154e+02           1.0
Mn    S
      3.848419e+02           1.0
Mn    S
      2.138010e+02           1.0
Mn    S
      1.187784e+02           1.0
Mn    S
      6.598798e+01           1.0
Mn    S
      3.665999e+01           1.0
Mn    S
      2.036666e+01           1.0
Mn    S
      1.131481e+01           1.0
Mn    S
      6.286006e+00           1.0
Mn    S
      3.492226e+00           1.0
Mn    S
      1.940125e+00           1.0
Mn    S
      1.077847e+00           1.0
Mn    S
      5.988041e-01           1.0
Mn    S
      3.326689e-01           1.0
Mn    S
      1.848161e-01           1.0
Mn    S
      1.026756e-01           1.0
Mn    S
      5.704200e-02           1.0
Mn    P
      1.313087e+03           1.0
Mn    P
      7.294927e+02           1.0
Mn    P
      4.052737e+02           1.0
Mn    P
      2.251521e+02           1.0
Mn    P
      1.250845e+02           1.0
Mn    P
      6.949138e+01           1.0
Mn    P
      3.860632e+01           1.0
Mn    P
      2.144796e+01           1.0
Mn    P
      1.191553e+01           1.0
Mn    P
      6.619740e+00           1.0
Mn    P
      3.677633e+00           1.0
Mn    P
      2.043130e+00           1.0
Mn    P
      1.135072e+00           1.0
Mn    P
      6.305956e-01           1.0
Mn    P
      3.503309e-01           1.0
Mn    P
      1.946283e-01           1.0
Mn    P
      1.081268e-01           1.0
Mn    P
      6.007045e-02           1.0
Mn    D
      7.662701e+02           1.0
Mn    D
      4.257056e+02           1.0
Mn    D
      2.365031e+02           1.0
Mn    D
      1.313906e+02           1.0
Mn    D
      7.299479e+01           1.0
Mn    D
      4.055266e+01           1.0
Mn    D
      2.252926e+01           1.0
Mn    D
      1.251625e+01           1.0
Mn    D
      6.953474e+00           1.0
Mn    D
      3.863041e+00           1.0
Mn    D
      2.146134e+00           1.0
Mn    D
      1.192297e+00           1.0
Mn    D
      6.623870e-01           1.0
Mn    D
      3.679928e-01           1.0
Mn    D
      2.044404e-01           1.0
Mn    D
      1.135780e-01           1.0
Mn    D
      6.309890e-02           1.0
Mn    F
      5.596301e+02           1.0
Mn    F
      3.109056e+02           1.0
Mn    F
      1.727253e+02           1.0
Mn    F
      9.595853e+01           1.0
Mn    F
      5.331029e+01           1.0
Mn    F
      2.961683e+01           1.0
Mn    F
      1.645379e+01           1.0
Mn    F
      9.140997e+00           1.0
Mn    F
      5.078331e+00           1.0
Mn    F
      2.821295e+00           1.0
Mn    F
      1.567386e+00           1.0
Mn    F
      8.707701e-01           1.0
Mn    F
      4.837612e-01           1.0
Mn    F
      2.687562e-01           1.0
Mn    F
      1.493090e-01           1.0
Mn    F
      8.294945e-02           1.0
Mn    G
      6.935547e+02           1.0
Mn    G
      3.853081e+02           1.0
Mn    G
      2.140601e+02           1.0
Mn    G
      1.189223e+02           1.0
Mn    G
      6.606793e+01           1.0
Mn    G
      3.670440e+01           1.0
Mn    G
      2.039134e+01           1.0
Mn    G
      1.132852e+01           1.0
Mn    G
      6.293622e+00           1.0
Mn    G
      3.496457e+00           1.0
Mn    G
      1.942476e+00           1.0
Mn    G
      1.079153e+00           1.0
Mn    G
      5.995296e-01           1.0
Mn    G
      3.330720e-01           1.0
Mn    G
      1.850400e-01           1.0
Mn    G
      1.028000e-01           1.0
Mn    H
      1.472927e+02           1.0
Mn    H
      6.404033e+01           1.0
Mn    H
      2.784362e+01           1.0
Mn    H
      1.210592e+01           1.0
Mn    H
      5.263444e+00           1.0
Mn    H
      2.288454e+00           1.0
Mn    H
      9.949800e-01           1.0
Mn    H
      4.326000e-01           1.0
Mn    I
      6.175440e+01           1.0
Mn    I
      2.058480e+01           1.0
Mn    I
      6.861600e+00           1.0
Mn    I
      2.287200e+00           1.0
Mn    I
      7.624000e-01           1.0
Mn    K
      3.329640e+01           1.0
Mn    K
      1.109880e+01           1.0
Mn    K
      3.699600e+00           1.0
Mn    K
      1.233200e+00           1.0
end
basis "Fe_cc-pwCVQZ-DK-autoaux" SPHERICAL 
#basis SET: (21s,18p,17d,16f,16g,8h,5i,4k) -> [21s,18p,17d,16f,16g,8h,5i,4k]
Fe    S
      7.746083e+03           1.0
Fe    S
      4.303380e+03           1.0
Fe    S
      2.390766e+03           1.0
Fe    S
      1.328204e+03           1.0
Fe    S
      7.378909e+02           1.0
Fe    S
      4.099394e+02           1.0
Fe    S
      2.277441e+02           1.0
Fe    S
      1.265245e+02           1.0
Fe    S
      7.029139e+01           1.0
Fe    S
      3.905077e+01           1.0
Fe    S
      2.169487e+01           1.0
Fe    S
      1.205271e+01           1.0
Fe    S
      6.695948e+00           1.0
Fe    S
      3.719971e+00           1.0
Fe    S
      2.066651e+00           1.0
Fe    S
      1.148139e+00           1.0
Fe    S
      6.378552e-01           1.0
Fe    S
      3.543640e-01           1.0
Fe    S
      1.968689e-01           1.0
Fe    S
      1.093716e-01           1.0
Fe    S
      6.076200e-02           1.0
Fe    P
      1.377015e+03           1.0
Fe    P
      7.650083e+02           1.0
Fe    P
      4.250046e+02           1.0
Fe    P
      2.361137e+02           1.0
Fe    P
      1.311743e+02           1.0
Fe    P
      7.287459e+01           1.0
Fe    P
      4.048588e+01           1.0
Fe    P
      2.249216e+01           1.0
Fe    P
      1.249564e+01           1.0
Fe    P
      6.942024e+00           1.0
Fe    P
      3.856680e+00           1.0
Fe    P
      2.142600e+00           1.0
Fe    P
      1.190333e+00           1.0
Fe    P
      6.612963e-01           1.0
Fe    P
      3.673868e-01           1.0
Fe    P
      2.041038e-01           1.0
Fe    P
      1.133910e-01           1.0
Fe    P
      6.299500e-02           1.0
Fe    D
      7.921258e+02           1.0
Fe    D
      4.400699e+02           1.0
Fe    D
      2.444833e+02           1.0
Fe    D
      1.358240e+02           1.0
Fe    D
      7.545780e+01           1.0
Fe    D
      4.192100e+01           1.0
Fe    D
      2.328944e+01           1.0
Fe    D
      1.293858e+01           1.0
Fe    D
      7.188100e+00           1.0
Fe    D
      3.993389e+00           1.0
Fe    D
      2.218549e+00           1.0
Fe    D
      1.232527e+00           1.0
Fe    D
      6.847375e-01           1.0
Fe    D
      3.804097e-01           1.0
Fe    D
      2.113387e-01           1.0
Fe    D
      1.174104e-01           1.0
Fe    D
      6.522800e-02           1.0
Fe    F
      6.080545e+02           1.0
Fe    F
      3.378080e+02           1.0
Fe    F
      1.876711e+02           1.0
Fe    F
      1.042617e+02           1.0
Fe    F
      5.792319e+01           1.0
Fe    F
      3.217955e+01           1.0
Fe    F
      1.787753e+01           1.0
Fe    F
      9.931960e+00           1.0
Fe    F
      5.517755e+00           1.0
Fe    F
      3.065420e+00           1.0
Fe    F
      1.703011e+00           1.0
Fe    F
      9.461172e-01           1.0
Fe    F
      5.256207e-01           1.0
Fe    F
      2.920115e-01           1.0
Fe    F
      1.622286e-01           1.0
Fe    F
      9.012700e-02           1.0
Fe    G
      7.760391e+02           1.0
Fe    G
      4.311328e+02           1.0
Fe    G
      2.395182e+02           1.0
Fe    G
      1.330657e+02           1.0
Fe    G
      7.392538e+01           1.0
Fe    G
      4.106966e+01           1.0
Fe    G
      2.281648e+01           1.0
Fe    G
      1.267582e+01           1.0
Fe    G
      7.042122e+00           1.0
Fe    G
      3.912290e+00           1.0
Fe    G
      2.173494e+00           1.0
Fe    G
      1.207497e+00           1.0
Fe    G
      6.708316e-01           1.0
Fe    G
      3.726842e-01           1.0
Fe    G
      2.070468e-01           1.0
Fe    G
      1.150260e-01           1.0
Fe    H
      1.749784e+02           1.0
Fe    H
      7.607757e+01           1.0
Fe    H
      3.307720e+01           1.0
Fe    H
      1.438139e+01           1.0
Fe    H
      6.252779e+00           1.0
Fe    H
      2.718600e+00           1.0
Fe    H
      1.182000e+00           1.0
Fe    H
      5.139130e-01           1.0
Fe    I
      7.393680e+01           1.0
Fe    I
      2.464560e+01           1.0
Fe    I
      8.215200e+00           1.0
Fe    I
      2.738400e+00           1.0
Fe    I
      9.128000e-01           1.0
Fe    K
      4.068630e+01           1.0
Fe    K
      1.356210e+01           1.0
Fe    K
      4.520700e+00           1.0
Fe    K
      1.506900e+00           1.0
end
basis "Co_cc-pwCVQZ-DK-autoaux" SPHERICAL 
#basis SET: (21s,18p,17d,16f,16g,8h,5i,4k) -> [21s,18p,17d,16f,16g,8h,5i,4k]
Co    S
      8.176974e+03           1.0
Co    S
      4.542763e+03           1.0
Co    S
      2.523757e+03           1.0
Co    S
      1.402087e+03           1.0
Co    S
      7.789374e+02           1.0
Co    S
      4.327430e+02           1.0
Co    S
      2.404128e+02           1.0
Co    S
      1.335627e+02           1.0
Co    S
      7.420148e+01           1.0
Co    S
      4.122304e+01           1.0
Co    S
      2.290169e+01           1.0
Co    S
      1.272316e+01           1.0
Co    S
      7.068423e+00           1.0
Co    S
      3.926902e+00           1.0
Co    S
      2.181612e+00           1.0
Co    S
      1.212007e+00           1.0
Co    S
      6.733371e-01           1.0
Co    S
      3.740761e-01           1.0
Co    S
      2.078201e-01           1.0
Co    S
      1.154556e-01           1.0
Co    S
      6.414200e-02           1.0
Co    P
      1.484037e+03           1.0
Co    P
      8.244651e+02           1.0
Co    P
      4.580362e+02           1.0
Co    P
      2.544645e+02           1.0
Co    P
      1.413692e+02           1.0
Co    P
      7.853844e+01           1.0
Co    P
      4.363247e+01           1.0
Co    P
      2.424026e+01           1.0
Co    P
      1.346681e+01           1.0
Co    P
      7.481561e+00           1.0
Co    P
      4.156423e+00           1.0
Co    P
      2.309124e+00           1.0
Co    P
      1.282847e+00           1.0
Co    P
      7.126926e-01           1.0
Co    P
      3.959403e-01           1.0
Co    P
      2.199668e-01           1.0
Co    P
      1.222038e-01           1.0
Co    P
      6.789100e-02           1.0
Co    D
      8.699928e+02           1.0
Co    D
      4.833293e+02           1.0
Co    D
      2.685163e+02           1.0
Co    D
      1.491757e+02           1.0
Co    D
      8.287540e+01           1.0
Co    D
      4.604189e+01           1.0
Co    D
      2.557883e+01           1.0
Co    D
      1.421046e+01           1.0
Co    D
      7.894700e+00           1.0
Co    D
      4.385944e+00           1.0
Co    D
      2.436636e+00           1.0
Co    D
      1.353687e+00           1.0
Co    D
      7.520481e-01           1.0
Co    D
      4.178045e-01           1.0
Co    D
      2.321136e-01           1.0
Co    D
      1.289520e-01           1.0
Co    D
      7.164000e-02           1.0
Co    F
      6.668717e+02           1.0
Co    F
      3.704843e+02           1.0
Co    F
      2.058246e+02           1.0
Co    F
      1.143470e+02           1.0
Co    F
      6.352611e+01           1.0
Co    F
      3.529228e+01           1.0
Co    F
      1.960682e+01           1.0
Co    F
      1.089268e+01           1.0
Co    F
      6.051489e+00           1.0
Co    F
      3.361938e+00           1.0
Co    F
      1.867743e+00           1.0
Co    F
      1.037635e+00           1.0
Co    F
      5.764640e-01           1.0
Co    F
      3.202578e-01           1.0
Co    F
      1.779210e-01           1.0
Co    F
      9.884500e-02           1.0
Co    G
      8.504140e+02           1.0
Co    G
      4.724522e+02           1.0
Co    G
      2.624735e+02           1.0
Co    G
      1.458186e+02           1.0
Co    G
      8.101033e+01           1.0
Co    G
      4.500574e+01           1.0
Co    G
      2.500319e+01           1.0
Co    G
      1.389066e+01           1.0
Co    G
      7.717034e+00           1.0
Co    G
      4.287241e+00           1.0
Co    G
      2.381800e+00           1.0
Co    G
      1.323222e+00           1.0
Co    G
      7.351236e-01           1.0
Co    G
      4.084020e-01           1.0
Co    G
      2.268900e-01           1.0
Co    G
      1.260500e-01           1.0
Co    H
      2.040597e+02           1.0
Co    H
      8.872161e+01           1.0
Co    H
      3.857461e+01           1.0
Co    H
      1.677157e+01           1.0
Co    H
      7.291987e+00           1.0
Co    H
      3.170429e+00           1.0
Co    H
      1.378447e+00           1.0
Co    H
      5.993250e-01           1.0
Co    I
      8.688060e+01           1.0
Co    I
      2.896020e+01           1.0
Co    I
      9.653400e+00           1.0
Co    I
      3.217800e+00           1.0
Co    I
      1.072600e+00           1.0
Co    K
      4.825710e+01           1.0
Co    K
      1.608570e+01           1.0
Co    K
      5.361900e+00           1.0
Co    K
      1.787300e+00           1.0
end
basis "Ni_cc-pwCVQZ-DK-autoaux" SPHERICAL 
#basis SET: (21s,18p,17d,17f,16g,8h,4i,3k) -> [21s,18p,17d,17f,16g,8h,4i,3k]
Ni    S
      8.592566e+03           1.0
Ni    S
      4.773648e+03           1.0
Ni    S
      2.652027e+03           1.0
Ni    S
      1.473348e+03           1.0
Ni    S
      8.185267e+02           1.0
Ni    S
      4.547371e+02           1.0
Ni    S
      2.526317e+02           1.0
Ni    S
      1.403509e+02           1.0
Ni    S
      7.797275e+01           1.0
Ni    S
      4.331819e+01           1.0
Ni    S
      2.406566e+01           1.0
Ni    S
      1.336981e+01           1.0
Ni    S
      7.427674e+00           1.0
Ni    S
      4.126485e+00           1.0
Ni    S
      2.292492e+00           1.0
Ni    S
      1.273607e+00           1.0
Ni    S
      7.075592e-01           1.0
Ni    S
      3.930885e-01           1.0
Ni    S
      2.183825e-01           1.0
Ni    S
      1.213236e-01           1.0
Ni    S
      6.740200e-02           1.0
Ni    P
      1.514290e+03           1.0
Ni    P
      8.412724e+02           1.0
Ni    P
      4.673735e+02           1.0
Ni    P
      2.596520e+02           1.0
Ni    P
      1.442511e+02           1.0
Ni    P
      8.013949e+01           1.0
Ni    P
      4.452194e+01           1.0
Ni    P
      2.473441e+01           1.0
Ni    P
      1.374134e+01           1.0
Ni    P
      7.634078e+00           1.0
Ni    P
      4.241154e+00           1.0
Ni    P
      2.356197e+00           1.0
Ni    P
      1.308998e+00           1.0
Ni    P
      7.272212e-01           1.0
Ni    P
      4.040118e-01           1.0
Ni    P
      2.244510e-01           1.0
Ni    P
      1.246950e-01           1.0
Ni    P
      6.927500e-02           1.0
Ni    D
      8.640180e+02           1.0
Ni    D
      4.800100e+02           1.0
Ni    D
      2.666722e+02           1.0
Ni    D
      1.481512e+02           1.0
Ni    D
      8.230624e+01           1.0
Ni    D
      4.572569e+01           1.0
Ni    D
      2.540316e+01           1.0
Ni    D
      1.411287e+01           1.0
Ni    D
      7.840482e+00           1.0
Ni    D
      4.355823e+00           1.0
Ni    D
      2.419902e+00           1.0
Ni    D
      1.344390e+00           1.0
Ni    D
      7.468832e-01           1.0
Ni    D
      4.149351e-01           1.0
Ni    D
      2.305195e-01           1.0
Ni    D
      1.280664e-01           1.0
Ni    D
      7.114800e-02           1.0
Ni    F
      1.287890e+03           1.0
Ni    F
      7.154943e+02           1.0
Ni    F
      3.974968e+02           1.0
Ni    F
      2.208316e+02           1.0
Ni    F
      1.226842e+02           1.0
Ni    F
      6.815789e+01           1.0
Ni    F
      3.786549e+01           1.0
Ni    F
      2.103639e+01           1.0
Ni    F
      1.168688e+01           1.0
Ni    F
      6.492712e+00           1.0
Ni    F
      3.607062e+00           1.0
Ni    F
      2.003923e+00           1.0
Ni    F
      1.113291e+00           1.0
Ni    F
      6.184949e-01           1.0
Ni    F
      3.436083e-01           1.0
Ni    F
      1.908935e-01           1.0
Ni    F
      1.060519e-01           1.0
Ni    G
      9.509785e+02           1.0
Ni    G
      5.283214e+02           1.0
Ni    G
      2.935119e+02           1.0
Ni    G
      1.630622e+02           1.0
Ni    G
      9.059009e+01           1.0
Ni    G
      5.032783e+01           1.0
Ni    G
      2.795990e+01           1.0
Ni    G
      1.553328e+01           1.0
Ni    G
      8.629600e+00           1.0
Ni    G
      4.794222e+00           1.0
Ni    G
      2.663457e+00           1.0
Ni    G
      1.479698e+00           1.0
Ni    G
      8.220546e-01           1.0
Ni    G
      4.566970e-01           1.0
Ni    G
      2.537205e-01           1.0
Ni    G
      1.409559e-01           1.0
Ni    H
      2.385686e+02           1.0
Ni    H
      1.037255e+02           1.0
Ni    H
      4.509803e+01           1.0
Ni    H
      1.960784e+01           1.0
Ni    H
      8.525148e+00           1.0
Ni    H
      3.706586e+00           1.0
Ni    H
      1.611559e+00           1.0
Ni    H
      7.006779e-01           1.0
Ni    I
      3.403080e+01           1.0
Ni    I
      1.134360e+01           1.0
Ni    I
      3.781200e+00           1.0
Ni    I
      1.260400e+00           1.0
Ni    K
      1.936530e+01           1.0
Ni    K
      6.455100e+00           1.0
Ni    K
      2.151700e+00           1.0
end
basis "Cu_cc-pwCVQZ-DK-autoaux" SPHERICAL 
#basis SET: (21s,18p,17d,16f,15g,8h,4i,3k) -> [21s,18p,17d,16f,15g,8h,4i,3k]
Cu    S
      9.001020e+03           1.0
Cu    S
      5.000566e+03           1.0
Cu    S
      2.778092e+03           1.0
Cu    S
      1.543385e+03           1.0
Cu    S
      8.574360e+02           1.0
Cu    S
      4.763533e+02           1.0
Cu    S
      2.646407e+02           1.0
Cu    S
      1.470226e+02           1.0
Cu    S
      8.167924e+01           1.0
Cu    S
      4.537735e+01           1.0
Cu    S
      2.520964e+01           1.0
Cu    S
      1.400536e+01           1.0
Cu    S
      7.780753e+00           1.0
Cu    S
      4.322641e+00           1.0
Cu    S
      2.401467e+00           1.0
Cu    S
      1.334148e+00           1.0
Cu    S
      7.411935e-01           1.0
Cu    S
      4.117742e-01           1.0
Cu    S
      2.287634e-01           1.0
Cu    S
      1.270908e-01           1.0
Cu    S
      7.060600e-02           1.0
Cu    P
      1.579343e+03           1.0
Cu    P
      8.774128e+02           1.0
Cu    P
      4.874515e+02           1.0
Cu    P
      2.708064e+02           1.0
Cu    P
      1.504480e+02           1.0
Cu    P
      8.358222e+01           1.0
Cu    P
      4.643457e+01           1.0
Cu    P
      2.579698e+01           1.0
Cu    P
      1.433166e+01           1.0
Cu    P
      7.962032e+00           1.0
Cu    P
      4.423351e+00           1.0
Cu    P
      2.457417e+00           1.0
Cu    P
      1.365232e+00           1.0
Cu    P
      7.584621e-01           1.0
Cu    P
      4.213678e-01           1.0
Cu    P
      2.340932e-01           1.0
Cu    P
      1.300518e-01           1.0
Cu    P
      7.225100e-02           1.0
Cu    D
      8.973896e+02           1.0
Cu    D
      4.985498e+02           1.0
Cu    D
      2.769721e+02           1.0
Cu    D
      1.538734e+02           1.0
Cu    D
      8.548521e+01           1.0
Cu    D
      4.749178e+01           1.0
Cu    D
      2.638432e+01           1.0
Cu    D
      1.465796e+01           1.0
Cu    D
      8.143310e+00           1.0
Cu    D
      4.524061e+00           1.0
Cu    D
      2.513367e+00           1.0
Cu    D
      1.396315e+00           1.0
Cu    D
      7.757306e-01           1.0
Cu    D
      4.309615e-01           1.0
Cu    D
      2.394230e-01           1.0
Cu    D
      1.330128e-01           1.0
Cu    D
      7.389600e-02           1.0
Cu    F
      1.013865e+03           1.0
Cu    F
      5.632583e+02           1.0
Cu    F
      3.129213e+02           1.0
Cu    F
      1.738451e+02           1.0
Cu    F
      9.658064e+01           1.0
Cu    F
      5.365591e+01           1.0
Cu    F
      2.980884e+01           1.0
Cu    F
      1.656047e+01           1.0
Cu    F
      9.200259e+00           1.0
Cu    F
      5.111255e+00           1.0
Cu    F
      2.839586e+00           1.0
Cu    F
      1.577548e+00           1.0
Cu    F
      8.764155e-01           1.0
Cu    F
      4.868975e-01           1.0
Cu    F
      2.704986e-01           1.0
Cu    F
      1.502770e-01           1.0
Cu    G
      8.495445e+02           1.0
Cu    G
      4.719692e+02           1.0
Cu    G
      2.622051e+02           1.0
Cu    G
      1.456695e+02           1.0
Cu    G
      8.092750e+01           1.0
Cu    G
      4.495972e+01           1.0
Cu    G
      2.497762e+01           1.0
Cu    G
      1.387646e+01           1.0
Cu    G
      7.709143e+00           1.0
Cu    G
      4.282857e+00           1.0
Cu    G
      2.379365e+00           1.0
Cu    G
      1.321869e+00           1.0
Cu    G
      7.343719e-01           1.0
Cu    G
      4.079844e-01           1.0
Cu    G
      2.266580e-01           1.0
Cu    H
      2.865940e+02           1.0
Cu    H
      1.246061e+02           1.0
Cu    H
      5.417657e+01           1.0
Cu    H
      2.355503e+01           1.0
Cu    H
      1.024132e+01           1.0
Cu    H
      4.452746e+00           1.0
Cu    H
      1.935977e+00           1.0
Cu    H
      8.417290e-01           1.0
Cu    I
      3.933360e+01           1.0
Cu    I
      1.311120e+01           1.0
Cu    I
      4.370400e+00           1.0
Cu    I
      1.456800e+00           1.0
Cu    K
      2.230020e+01           1.0
Cu    K
      7.433400e+00           1.0
Cu    K
      2.477800e+00           1.0
end
basis "Zn_cc-pwCVQZ-DK-autoaux" SPHERICAL 
#basis SET: (22s,19p,18d,16f,15g,8h,4i,3k) -> [22s,19p,18d,16f,15g,8h,4i,3k]
Zn    S
      1.688014e+04           1.0
Zn    S
      9.377858e+03           1.0
Zn    S
      5.209921e+03           1.0
Zn    S
      2.894400e+03           1.0
Zn    S
      1.608000e+03           1.0
Zn    S
      8.933335e+02           1.0
Zn    S
      4.962964e+02           1.0
Zn    S
      2.757202e+02           1.0
Zn    S
      1.531779e+02           1.0
Zn    S
      8.509883e+01           1.0
Zn    S
      4.727713e+01           1.0
Zn    S
      2.626507e+01           1.0
Zn    S
      1.459171e+01           1.0
Zn    S
      8.106503e+00           1.0
Zn    S
      4.503613e+00           1.0
Zn    S
      2.502007e+00           1.0
Zn    S
      1.390004e+00           1.0
Zn    S
      7.722245e-01           1.0
Zn    S
      4.290136e-01           1.0
Zn    S
      2.383409e-01           1.0
Zn    S
      1.324116e-01           1.0
Zn    S
      7.356200e-02           1.0
Zn    P
      2.966877e+03           1.0
Zn    P
      1.648265e+03           1.0
Zn    P
      9.157026e+02           1.0
Zn    P
      5.087237e+02           1.0
Zn    P
      2.826243e+02           1.0
Zn    P
      1.570135e+02           1.0
Zn    P
      8.722971e+01           1.0
Zn    P
      4.846095e+01           1.0
Zn    P
      2.692275e+01           1.0
Zn    P
      1.495708e+01           1.0
Zn    P
      8.309491e+00           1.0
Zn    P
      4.616384e+00           1.0
Zn    P
      2.564658e+00           1.0
Zn    P
      1.424810e+00           1.0
Zn    P
      7.915610e-01           1.0
Zn    P
      4.397561e-01           1.0
Zn    P
      2.443090e-01           1.0
Zn    P
      1.357272e-01           1.0
Zn    P
      7.540400e-02           1.0
Zn    D
      1.688529e+03           1.0
Zn    D
      9.380718e+02           1.0
Zn    D
      5.211510e+02           1.0
Zn    D
      2.895283e+02           1.0
Zn    D
      1.608491e+02           1.0
Zn    D
      8.936060e+01           1.0
Zn    D
      4.964478e+01           1.0
Zn    D
      2.758043e+01           1.0
Zn    D
      1.532246e+01           1.0
Zn    D
      8.512479e+00           1.0
Zn    D
      4.729155e+00           1.0
Zn    D
      2.627308e+00           1.0
Zn    D
      1.459616e+00           1.0
Zn    D
      8.108976e-01           1.0
Zn    D
      4.504987e-01           1.0
Zn    D
      2.502770e-01           1.0
Zn    D
      1.390428e-01           1.0
Zn    D
      7.724600e-02           1.0
Zn    F
      1.326221e+03           1.0
Zn    F
      7.367894e+02           1.0
Zn    F
      4.093274e+02           1.0
Zn    F
      2.274041e+02           1.0
Zn    F
      1.263356e+02           1.0
Zn    F
      7.018646e+01           1.0
Zn    F
      3.899248e+01           1.0
Zn    F
      2.166249e+01           1.0
Zn    F
      1.203472e+01           1.0
Zn    F
      6.685953e+00           1.0
Zn    F
      3.714418e+00           1.0
Zn    F
      2.063566e+00           1.0
Zn    F
      1.146425e+00           1.0
Zn    F
      6.369030e-01           1.0
Zn    F
      3.538350e-01           1.0
Zn    F
      1.965750e-01           1.0
Zn    G
      1.184050e+03           1.0
Zn    G
      6.578058e+02           1.0
Zn    G
      3.654477e+02           1.0
Zn    G
      2.030265e+02           1.0
Zn    G
      1.127925e+02           1.0
Zn    G
      6.266249e+01           1.0
Zn    G
      3.481250e+01           1.0
Zn    G
      1.934028e+01           1.0
Zn    G
      1.074460e+01           1.0
Zn    G
      5.969221e+00           1.0
Zn    G
      3.316234e+00           1.0
Zn    G
      1.842352e+00           1.0
Zn    G
      1.023529e+00           1.0
Zn    G
      5.686272e-01           1.0
Zn    G
      3.159040e-01           1.0
Zn    H
      3.398874e+02           1.0
Zn    H
      1.477771e+02           1.0
Zn    H
      6.425092e+01           1.0
Zn    H
      2.793518e+01           1.0
Zn    H
      1.214573e+01           1.0
Zn    H
      5.280753e+00           1.0
Zn    H
      2.295980e+00           1.0
Zn    H
      9.982520e-01           1.0
Zn    I
      4.537620e+01           1.0
Zn    I
      1.512540e+01           1.0
Zn    I
      5.041800e+00           1.0
Zn    I
      1.680600e+00           1.0
Zn    K
      2.590290e+01           1.0
Zn    K
      8.634300e+00           1.0
Zn    K
      2.878100e+00           1.0
end
