%chk=000081549.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081549

0 1
 O  -0.7455000     -0.8281000     -9.9999997E-05
 O   -3.044100     -0.8090000       0.000000    
 N  -0.4031000       1.391000     -9.9999997E-05
 N   -1.731400       1.125900      9.9999997E-05
 C    1.586800     -0.1350000      9.9999997E-05
 C    2.379100       1.173800      1.4000000E-03
 C    1.905000     -0.9496000      -1.256000    
 C    1.903800     -0.9515000       1.255100    
 C   0.1213000      0.2091000     -6.0000003E-04
 C   -1.972000     -0.2267000      9.9999997E-05
 H    2.157400       1.782700     -0.8831000    
 H    2.156500       1.781300      0.8866000    
 H    3.457500      0.9776000      1.8000000E-03
 H    1.626000     -0.4022000      -2.163900    
 H    1.359400      -1.900100      -1.271000    
 H    2.974600      -1.179700      -1.317000    
 H    1.358500      -1.902200       1.268000    
 H    1.623500     -0.4056000       2.163600    
 H    2.973300      -1.181300       1.317100    
 H   -2.404200       1.882100      3.0000001E-04


%chk=000081549-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081549

0 1
O -0.793055 -0.851362 -0.000728
O -3.192270 -0.854823 -0.001270
N -0.431871 1.414218 0.000562
N -1.818234 1.120455 0.000144
C 1.611869 -0.115034 0.000256
C 2.434499 1.198121 0.001373
C 1.933862 -0.954619 -1.273447
C 1.933275 -0.956408 1.272937
C 0.141852 0.217107 0.000136
C -2.119960 -0.236069 -0.000647
H 2.214886 1.809847 -0.890495
H 2.214590 1.808543 0.894063
H 3.510693 0.949560 0.001377
H 1.734070 -0.374466 -2.192096
H 1.330878 -1.878193 -1.303946
H 3.003040 -1.232962 -1.265763
H 1.330514 -1.880185 1.301713
H 1.732754 -0.377671 2.192319
H 3.002529 -1.234475 1.265523
H -2.491519 1.880915 0.000389


