%chk=000006838.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006838

0 1
 O    1.066600       2.773700      2.6000000E-03
 N  -6.8700001E-02  0.8582000     -2.2900000E-02
 N  -5.1800001E-02   2.245400      1.5900001E-02
 C   -1.313000      0.1943000     -1.0200000E-02
 C    1.207200      0.1435000     -1.1600000E-02
 C   -1.359900      -1.199600      1.4000000E-02
 C    1.769400     -0.1930000      -1.214500    
 C   -2.497000      0.9318000     -2.2299999E-02
 C    1.771100     -0.1512000       1.201300    
 C   -2.590600      -1.856000      2.6000001E-02
 C    2.986000     -0.8752000      -1.203500    
 C   -3.727700      0.2753000     -1.0300000E-02
 C    2.987700     -0.8333000       1.212100    
 C   -3.774400      -1.118600      1.3800000E-02
 C    3.595200      -1.195300      9.7000003E-03
 H  -0.4668000      -1.816900      2.4100000E-02
 H    1.297400      5.4900002E-02  -2.159800    
 H   -2.515500       2.017800     -4.3800000E-02
 H    1.300500      0.1285000       2.138500    
 H   -2.627800      -2.941300      4.4700000E-02
 H    3.458900      -1.157100      -2.139700    
 H   -4.650100      0.8488000     -2.0400001E-02
 H    3.462000      -1.082800       2.156800    
 H   -4.732600      -1.629700      2.2900000E-02
 H    4.542500      -1.726500      1.8200001E-02


%chk=000006838-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006838

0 1
O 0.908815 2.719780 1.151300
N -0.076029 0.776151 0.448882
N -0.193634 2.125409 0.918566
C -1.333920 0.148981 0.142068
C 1.189062 0.115253 0.226868
C -1.466636 -1.258454 0.262587
C 1.439239 -0.504136 -1.024245
C -2.446965 0.938176 -0.249009
C 2.185040 0.123554 1.234358
C -2.706631 -1.870838 -0.015859
C 2.679544 -1.133491 -1.257186
C -3.683405 0.312787 -0.511383
C 3.424905 -0.505079 0.987428
C -3.821581 -1.090816 -0.400529
C 3.676873 -1.134742 -0.253106
H -0.610348 -1.863115 0.576954
H 0.666622 -0.491065 -1.800019
H -2.334137 2.020541 -0.345124
H 1.990643 0.606108 2.195107
H -2.802231 -2.958098 0.077586
H 2.869227 -1.615300 -2.222383
H -4.539930 0.924690 -0.814714
H 4.195578 -0.500712 1.765612
H -4.782822 -1.569771 -0.614775
H 4.641322 -1.620115 -0.437384


