%chk=000079194.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079194

0 1
 O    2.922000      -1.722700     -1.9000000E-03
 O   -3.003700       1.287800     -3.3000000E-03
 N   -1.767400     -0.7197000      1.2000001E-03
 C    2.214600      0.5678000     -3.0000001E-04
 C  -0.4397000     -0.2907000      2.4000001E-03
 C    1.922800     -0.7962000     -3.0000001E-04
 C   0.5957000      -1.225400      1.0000000E-03
 C  -0.1478000       1.073300      2.4999999E-03
 C    1.179300       1.502600      1.3000000E-03
 C    3.629300       1.045900     -1.7000000E-03
 C   -2.929400      6.3299999E-02  9.9999997E-05
 C   -4.175800     -0.7859000     -1.0000000E-03
 H   0.3760000      -2.290700      5.0000002E-04
 H  -0.8942000       1.855400      3.8999999E-03
 H    1.390600       2.568700      1.5000000E-03
 H   -1.897600      -1.729200      8.9999998E-04
 H    4.155700      0.6964000      0.8927000    
 H    4.153600      0.6969000     -0.8975000    
 H    3.686200       2.140100     -1.5000000E-03
 H   -4.205900      -1.396400     -0.9079000    
 H   -5.061200     -0.1449000      2.5800001E-02
 H   -4.182600      -1.436400      0.8782000    
 H    3.792900      -1.296200     -2.7000001E-03


%chk=000079194-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079194

0 1
O 2.883566 -1.783813 0.000204
O -3.065391 1.287971 0.003092
N -1.804993 -0.696388 0.002074
C 2.275511 0.619985 -0.000716
C -0.466162 -0.206811 0.001095
C 1.916878 -0.758204 0.000171
C 0.572512 -1.172292 0.001076
C -0.143055 1.176161 0.000205
C 1.215544 1.555776 -0.000679
C 3.733514 1.044233 -0.001613
C -3.003228 0.024134 0.001951
C -4.249504 -0.865051 -0.001259
H 0.358807 -2.247358 0.001745
H -0.943715 1.916029 0.000456
H 1.461130 2.624677 -0.001314
H -1.895502 -1.715300 0.002334
H 4.278372 0.682708 0.894634
H 4.277546 0.681691 -0.897950
H 3.816109 2.143612 -0.002266
H -4.295954 -1.485373 -0.915688
H -5.138796 -0.219624 0.032072
H -4.266510 -1.539967 0.874627
H 3.796722 -1.402997 -0.000351


