%chk=000058320.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058320

0 1
 O   0.9144000      0.9632000      0.7474000    
 O    3.083400       1.117700      0.3572000    
 O    1.742700      0.1260000      -1.234100    
 N   -3.101900       1.772800     -4.1400000E-02
 C  -0.4140000      0.5653000      0.3684000    
 C  -0.7915000       1.414800     -0.8673000    
 C   -1.357300      0.9951000       1.515300    
 C   -2.288600       1.376900      -1.197700    
 C   -2.832800      0.9148000       1.118700    
 C  -0.3732000     -0.9525000      0.1752000    
 C   -4.524200       1.748200     -0.3806000    
 C  -0.6688000      -1.503700      -1.070600    
 C  -4.0899999E-02  -1.781500       1.245600    
 C    1.899100      0.6795000     -0.1540000    
 C  -0.6322000      -2.887000      -1.246600    
 C  -4.0000002E-03  -3.164700       1.069700    
 C  -0.2998000      -3.717500     -0.1763000    
 C    4.232100      0.8963000     -0.4676000    
 C    5.457500       1.436300      0.2384000    
 H  -0.2369000       1.158000      -1.774600    
 H  -0.5124000       2.461100     -0.6694000    
 H   -1.120300       2.028500       1.808300    
 H   -1.189000      0.4059000       2.424100    
 H   -2.466100       2.080700      -2.020700    
 H   -2.596100      0.3902000      -1.558500    
 H   -3.116400     -0.1262000      0.9181000    
 H   -3.431300       1.254600       1.972800    
 H   -4.867300      0.7445000     -0.6564000    
 H   -4.732600       2.425800      -1.216000    
 H   -5.127300       2.098400      0.4646000    
 H  -0.9063000     -0.9100000      -1.944400    
 H   0.2081000      -1.372600       2.220700    
 H  -0.8559000      -3.317800      -2.218200    
 H   0.2587000      -3.811300       1.901800    
 H  -0.2688000      -4.794400     -0.3138000    
 H    4.351200     -0.1781000     -0.6467000    
 H    4.098800       1.412200      -1.425000    
 H    6.356100       1.283300     -0.3656000    
 H    5.345400       2.506700      0.4407000    
 H    5.593600      0.9425000       1.206200    


%chk=000058320-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058320

0 1
O 0.959610 0.994198 0.618284
O 3.165753 1.136190 0.391162
O 1.930984 0.347290 -1.440158
N -3.155889 1.767877 -0.029270
C -0.454073 0.550934 0.205327
C -0.901649 1.362480 -1.032065
C -1.284126 1.026145 1.422163
C -2.432746 1.319185 -1.241437
C -2.796654 0.935879 1.143295
C -0.433413 -0.978722 0.052832
C -4.613478 1.838551 -0.244713
C -0.753369 -1.636267 -1.160058
C -0.048917 -1.772866 1.166891
C 1.996102 0.776511 -0.265031
C -0.716465 -3.045436 -1.252509
C -0.003566 -3.179620 1.076794
C -0.346782 -3.824746 -0.134172
C 4.409199 1.000061 -0.430392
C 5.565794 1.420974 0.469048
H -0.378136 1.026279 -1.941515
H -0.613051 2.414073 -0.849301
H -1.019507 2.079849 1.619871
H -1.030126 0.437411 2.320019
H -2.694202 1.997556 -2.075326
H -2.753957 0.289194 -1.543452
H -3.095463 -0.135253 0.999579
H -3.348862 1.314611 2.023249
H -5.076472 0.845752 -0.478625
H -4.832782 2.522889 -1.084026
H -5.104592 2.239331 0.660111
H -1.009821 -1.055835 -2.050401
H 0.243483 -1.285423 2.103496
H -0.965606 -3.532855 -2.201782
H 0.302284 -3.771492 1.946914
H -0.315476 -4.917691 -0.206821
H 4.492218 -0.049093 -0.766890
H 4.310830 1.643939 -1.323269
H 6.518487 1.343051 -0.086058
H 5.442665 2.464203 0.806191
H 5.626973 0.772889 1.359745


