%chk=000066085.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066085

0 1
 O    5.147600     -0.6844000     -4.1000001E-02
 O    4.159300       1.359000     -3.8000001E-03
 N   -6.059900      0.4760000      4.1000001E-02
 C   -1.029500      0.2919000     -2.5400000E-02
 C   0.2329000     -0.5767000     -5.0000002E-04
 C   -2.324600     -0.5246000     -2.9500000E-02
 C    1.529500      0.2405000      2.7899999E-02
 C   -3.588100      0.3454000     -4.8000000E-02
 C    2.776000     -0.6456000      5.9799999E-02
 C   -4.911300     -0.4209000      8.8000000E-03
 C    4.068100      0.1394000      1.0700000E-02
 H   -1.005700      0.9357000     -0.9133000    
 H   -1.025400      0.9558000      0.8479000    
 H   0.2365000      -1.230200     -0.8816000    
 H   0.2015000      -1.230600      0.8798000    
 H   -2.334200      -1.188200     -0.9026000    
 H   -2.347000      -1.167800      0.8587000    
 H    1.528900      0.9007000      0.9041000    
 H    1.565900      0.8928000     -0.8536000    
 H   -3.571700      0.9675000     -0.9525000    
 H   -3.542600       1.037000      0.8038000    
 H    2.778500      -1.244800      0.9771000    
 H    2.763200      -1.321100     -0.8033000    
 H   -4.996900      -1.080500     -0.8614000    
 H   -4.934900      -1.057300      0.9001000    
 H   -6.042500       1.081300     -0.7792000    
 H   -5.985400       1.096600      0.8463000    
 H    5.988900     -0.1818000     -8.3800003E-02


%chk=000066085-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066085

0 1
O 5.214833 -0.767450 -0.016845
O 4.264808 1.349842 0.010421
N -6.160203 0.397739 -0.009727
C -1.008263 0.331777 -0.005317
C 0.251134 -0.563368 0.007991
C -2.327893 -0.472140 0.008181
C 1.564840 0.248010 -0.007051
C -3.590288 0.419784 -0.006236
C 2.808339 -0.660372 0.007716
C -4.912028 -0.394964 0.007011
C 4.113689 0.108836 0.000297
H -0.985549 0.983612 -0.903236
H -0.984278 1.011374 0.871708
H 0.224077 -1.243646 -0.869041
H 0.226395 -1.214069 0.907291
H -2.350607 -1.153288 -0.868445
H -2.350120 -1.124136 0.906704
H 1.596959 0.928963 0.864846
H 1.594950 0.898118 -0.902392
H -3.576252 1.070220 -0.906005
H -3.576030 1.099041 0.871954
H 2.809949 -1.317674 0.900019
H 2.813549 -1.345794 -0.862515
H -4.929327 -1.076198 -0.866246
H -4.932161 -1.043280 0.904928
H -6.287935 0.945998 -0.867063
H -6.289624 0.979379 0.825058
H 6.054135 -0.231215 -0.017507


