%chk=000149879.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149879

0 1
 O  -8.4500000E-02  -2.014900     -3.9700001E-02
 O    4.668400     -0.3055000      0.3434000    
 O    6.447100       1.149000      6.7299999E-02
 N    3.866100      0.7258000     -9.4099998E-02
 N   -1.689900      0.2207000     -0.5791000    
 N   -2.234500      0.3793000      0.5388000    
 C   0.4845000     -0.7854000     -0.1873000    
 C    2.467100      0.5948000     -0.2152000    
 C  -0.2948000      0.3367000     -0.4548000    
 C    1.868000     -0.6562000     -6.7199998E-02
 C    1.682400       1.716500     -0.4835000    
 C   0.2988000       1.587200     -0.6035000    
 C   -3.622500      0.2642000      0.4156000    
 C   -4.234900     -0.9805000      0.5615000    
 C   -4.394900       1.394200      0.1468000    
 C   -5.619600      -1.095300      0.4386000    
 C   -5.779500       1.279400      2.4000000E-02
 C  -0.2273000      -2.807900      -1.216200    
 C   -6.391900      3.4600001E-02  0.1698000    
 C    5.983500      5.9200000E-02  0.3768000    
 C    6.808400      -1.096000      0.8581000    
 H    2.464400      -1.541400      0.1404000    
 H    2.137300       2.696600     -0.6014000    
 H  -0.3043000       2.466600     -0.8136000    
 H    4.272800       1.653700     -0.1337000    
 H   -3.641500      -1.866800      0.7712000    
 H   -3.927200       2.368600      3.2099999E-02
 H   -6.096400      -2.064500      0.5521000    
 H   -6.381100       2.159200     -0.1850000    
 H  -0.8587000      -2.299200      -1.951400    
 H  -0.7062000      -3.750500     -0.9376000    
 H   0.7527000      -3.028300      -1.651000    
 H   -7.470000     -5.4699998E-02  7.4100003E-02
 H    6.701700      -1.939500      0.1714000    
 H    7.861500     -0.8021000      0.8877000    
 H    6.497800      -1.378600       1.867100    


%chk=000149879-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149879

0 1
O 0.576845 -2.417006 -0.371974
O 4.951031 -0.211722 -0.136578
O 6.301874 1.414086 0.844877
N 4.036313 0.899228 -0.416220
N -1.512099 -0.279540 -0.217555
N -2.309223 0.766249 -0.154510
C 0.826138 -1.050697 -0.324225
C 2.674438 0.564339 -0.309328
C -0.130219 0.022953 -0.250402
C 2.215290 -0.764302 -0.355013
C 1.737691 1.647700 -0.236207
C 0.376564 1.364015 -0.209184
C -3.703533 0.447015 -0.119849
C -4.252274 -0.868552 -0.145646
C -4.575515 1.567500 -0.054800
C -5.648156 -1.045595 -0.106494
C -5.972987 1.382016 -0.016048
C -0.772465 -3.004317 -0.367450
C -6.515239 0.075249 -0.041659
C 6.137792 0.219189 0.513242
C 7.084272 -0.939120 0.682299
H 2.912742 -1.601414 -0.412950
H 2.094717 2.683288 -0.206541
H -0.365642 2.165692 -0.149702
H 4.397709 1.755829 0.038074
H -3.572297 -1.723989 -0.195776
H -4.129445 2.567501 -0.036194
H -6.069552 -2.057358 -0.126413
H -6.638014 2.251225 0.033824
H -1.313061 -2.747927 0.558755
H -0.586029 -4.088353 -0.430836
H -1.361515 -2.651249 -1.230040
H -7.600687 -0.071324 -0.011640
H 7.984692 -0.769164 0.065755
H 7.407592 -0.994693 1.735259
H 6.615054 -1.887752 0.383649


