%chk=000158503.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158503

0 1
 O    1.044100       2.595600     -6.9999998E-04
 O    3.465900       1.533200     -7.2400004E-02
 O    3.853100      -1.159000     -0.1166000    
 O   -3.191500      -2.249000      4.1900001E-02
 N  -0.7394000      -3.266700     -3.0999999E-02
 C   0.1714000     -0.9996000     -2.5000000E-02
 C  -4.3800000E-02  0.4009000     -1.7000000E-03
 C   -1.435000      0.9181000      3.9299998E-02
 C    1.477400      -1.539900     -6.3199997E-02
 C  -0.8780000      -1.920700     -1.1300000E-02
 C   -2.522400      1.8500000E-02  5.3500000E-02
 C    1.090500       1.232200     -1.8600000E-02
 C   -2.270500      -1.442200      2.8800000E-02
 C    2.576100     -0.6746000     -7.8800000E-02
 C    2.382200      0.7021000     -5.6699999E-02
 C   -1.747500       2.290400      6.6299997E-02
 C    1.649300      -2.929200     -8.4399998E-02
 C   -3.850700      0.4677000      9.2000000E-02
 C   0.5235000      -3.735800     -6.7100003E-02
 C   -3.071700       2.741100      0.1050000    
 C   -4.121500       1.831200      0.1174000    
 C    1.630500       3.276500      -1.107000    
 C    4.008000       1.909300       1.190300    
 H   -1.016300       3.083900      6.8300001E-02
 H    2.619800      -3.412400     -9.7300000E-02
 H   -4.683400     -0.2302000      0.1029000    
 H   0.6149000      -4.816900     -7.8500003E-02
 H   -3.279500       3.807400      0.1271000    
 H   -5.148200       2.183000      0.1478000    
 H    3.877500      -2.006700     -0.5874000    
 H    2.568900       3.748700     -0.8027000    
 H   0.9447000       4.074300      -1.408900    
 H    1.788800       2.628400      -1.976600    
 H    3.259400       2.430600       1.795200    
 H    4.847000       2.588000       1.013900    
 H    4.377400       1.030600       1.728300    


%chk=000158503-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158503

0 1
O 0.887910 2.704855 -0.081730
O 3.428885 1.730551 -0.006986
O 3.943115 -1.022406 0.063885
O -3.306822 -2.286822 -0.294012
N -0.736486 -3.269504 -0.014811
C 0.147746 -0.957090 0.013310
C -0.101439 0.467876 -0.008185
C -1.506140 0.951756 0.018184
C 1.493706 -1.490413 0.043517
C -0.924155 -1.924767 -0.038726
C -2.582572 0.006251 -0.074553
C 1.040918 1.315578 -0.052183
C -2.351823 -1.462972 -0.151343
C 2.610271 -0.587113 0.041685
C 2.387317 0.794863 0.010821
C -1.863903 2.327572 0.162902
C 1.666712 -2.906168 0.074913
C -3.934703 0.438176 -0.070584
C 0.544751 -3.742734 0.057128
C -3.209972 2.740333 0.174287
C -4.259454 1.798434 0.045061
C 1.469866 3.437096 -1.236311
C 4.412891 1.673162 1.101072
H -1.073007 3.066502 0.277292
H 2.659024 -3.373515 0.117898
H -4.707040 -0.333287 -0.152241
H 0.651570 -4.831945 0.093424
H -3.440358 3.805482 0.290642
H -5.305077 2.123675 0.049565
H 4.001803 -2.007798 0.005954
H 2.561854 3.302247 -1.265490
H 1.211003 4.491528 -1.058525
H 1.002570 3.084076 -2.174081
H 3.893665 1.770377 2.072346
H 5.069851 2.540008 0.936229
H 4.988521 0.734938 1.061745


