%chk=000147689.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147689

0 1
 O   -2.353600       1.978900       1.558000    
 O   -3.931000       2.254500      -1.656600    
 N   0.4746000      -2.415100     -7.7699997E-02
 C   -2.261500      6.8700001E-02  9.6199997E-02
 C   -2.519400       1.564100      0.1982000    
 C  -0.9348000     -0.4654000      4.3000001E-02
 C   -3.926400       2.006500     -0.2511000    
 C   -3.364700     -0.8078000      0.1225000    
 C  -0.7439000      -1.854200     -1.6700000E-02
 C    1.542500     -0.2513000     -6.6999998E-03
 C   0.2462000      0.3097000      5.4499999E-02
 C   -4.996700      0.9970000      2.2600001E-02
 C   -4.735900     -0.3011000      0.2122000    
 C    1.581300      -1.653300     -7.4900001E-02
 C   -3.150300      -2.183500      7.4299999E-02
 C    2.767700      0.5094000     -2.7999999E-03
 C   -1.853800      -2.687500     -2.3000001E-03
 C    4.002100     -0.1807000     -7.0200004E-02
 C    2.811000      -2.288200     -0.1393000    
 C    4.006300      -1.573900     -0.1378000    
 C    2.831900       1.924100      6.4000003E-02
 C    5.219100      0.5228000     -6.9799997E-02
 C    4.047400       2.613600      6.3900001E-02
 C    5.241700       1.912500     -3.3000000E-03
 H   -1.791700       2.111000     -0.4113000    
 H   -4.193300       2.947300      0.2439000    
 H   0.1513000       1.390100      0.1172000    
 H   -6.026400       1.341800      5.1300000E-02
 H   -5.543000      -1.002400      0.3953000    
 H   -3.984300      -2.881300      9.1700003E-02
 H   -1.720200      -3.767500     -4.3499999E-02
 H    2.858100      -3.374800     -0.1922000    
 H   -1.622400       1.475800       1.953700    
 H    4.942400      -2.126500     -0.1902000    
 H    1.927900       2.525300      0.1178000    
 H   -3.601800       1.457300      -2.106200    
 H    6.166500     -1.0600000E-02 -0.1219000    
 H    4.054900       3.698500      0.1162000    
 H    6.188600       2.443500     -3.7000000E-03


%chk=000147689-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000147689

0 1
O -2.140532 2.070597 1.526274
O -3.901666 2.347345 -1.726869
N 0.517135 -2.520857 -0.078959
C -2.234724 0.060768 0.091478
C -2.461564 1.563184 0.162537
C -0.900841 -0.484122 0.038468
C -3.875267 2.036643 -0.268773
C -3.346130 -0.807100 0.138837
C -0.719330 -1.928642 -0.006737
C 1.555021 -0.263124 -0.010993
C 0.274068 0.319722 0.053337
C -4.984398 1.064414 0.057603
C -4.714073 -0.265844 0.212161
C 1.622377 -1.718773 -0.090976
C -3.148182 -2.234521 0.121066
C 2.803141 0.512691 -0.001989
C -1.875020 -2.781921 0.038379
C 4.059747 -0.185980 -0.094229
C 2.911873 -2.371174 -0.180211
C 4.076942 -1.634561 -0.184841
C 2.827852 1.935578 0.093292
C 5.280754 0.551667 -0.093792
C 4.039649 2.644523 0.093440
C 5.277365 1.950600 -0.002162
H -1.755304 2.110541 -0.484447
H -4.036181 3.020325 0.203018
H 0.165684 1.403789 0.135494
H -6.010127 1.446835 0.085214
H -5.529609 -0.982321 0.372737
H -4.028036 -2.887477 0.163142
H -1.705230 -3.862202 0.012421
H 2.909873 -3.463209 -0.241990
H -2.572502 1.475534 2.192181
H 5.049251 -2.136690 -0.254692
H 1.892157 2.497731 0.173152
H -3.996841 1.493619 -2.224222
H 6.228146 0.004435 -0.165954
H 4.030882 3.737171 0.168564
H 6.220040 2.508108 -0.002657


