%chk=000042164.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042164

0 1
 O    1.146800       1.594700       1.647400    
 O   -5.463500     -7.9200000E-02  -1.564300    
 N   -4.475700      -1.009400      0.3638000    
 C    3.344600      0.3434000     -0.4535000    
 C    4.874500      0.3218000     -0.4384000    
 C    2.812400       1.759000     -0.6983000    
 C    5.408900      -1.095900     -0.2274000    
 C    1.283600       1.807100     -0.7528000    
 C    6.937000      -1.122000     -0.2456000    
 C   0.6191000       1.400200      0.5549000    
 C    7.472100      -2.534200     -6.9499999E-02
 C  -0.7277000      0.7630000      0.5035000    
 C   -1.579300       1.099000     -0.5248000    
 C   -1.070100     -0.1375000       1.487300    
 C   -3.215200     -0.4130000      0.4105000    
 C   -2.839700      0.5032000     -0.5719000    
 C   -2.330400     -0.7334000       1.440100    
 C   -5.490000     -0.8154000     -0.5833000    
 C   -6.707500      -1.651300     -0.2779000    
 H    2.976200     -0.3249000      -1.241300    
 H    2.971100     -4.6500001E-02  0.5000000    
 H    5.244300      0.9773000      0.3594000    
 H    5.255600      0.7195000      -1.386900    
 H    3.175800       2.427600      9.1600001E-02
 H    3.209200       2.139400      -1.647200    
 H    5.044700      -1.488600      0.7297000    
 H    5.022200      -1.754200      -1.015000    
 H   0.9488000       1.146900      -1.560700    
 H   0.9618000       2.828300     -0.9858000    
 H    7.305800     -0.7152000      -1.194400    
 H    7.329600     -0.4847000      0.5553000    
 H    8.566500      -2.529400     -8.3999999E-02
 H    7.146800      -2.960600      0.8848000    
 H    7.124600      -3.188900     -0.8750000    
 H   -1.317400       1.822300      -1.290200    
 H  -0.3891000     -0.3999000       2.291300    
 H   -3.471300      0.8043000      -1.396000    
 H   -2.609300      -1.446600       2.211600    
 H   -4.673600      -1.665900       1.116200    
 H   -6.444600      -2.712300     -0.3106000    
 H   -7.487400      -1.455000      -1.018900    
 H   -7.091000      -1.399900      0.7149000    


%chk=000042164-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000042164

0 1
O 1.217118 0.466071 1.612016
O -5.760762 -0.140081 -1.730372
N -5.036781 -0.655100 0.445121
C 3.615644 0.084645 -0.539985
C 5.133367 0.322977 -0.378262
C 2.803409 1.399969 -0.544846
C 5.962313 -0.981202 -0.380521
C 1.286312 1.189626 -0.721772
C 7.480159 -0.741340 -0.211917
C 0.585409 0.631108 0.524302
C 8.302672 -2.048225 -0.217067
C -0.876874 0.306168 0.442125
C -1.651142 0.494669 -0.734094
C -1.526047 -0.207197 1.599338
C -3.658238 -0.322562 0.392379
C -3.024803 0.189409 -0.773327
C -2.891747 -0.517963 1.578097
C -6.006371 -0.561086 -0.564745
C -7.394916 -1.022639 -0.122884
H 3.431119 -0.466987 -1.486624
H 3.255641 -0.559262 0.284934
H 5.315022 0.869880 0.570431
H 5.492153 0.985999 -1.194247
H 2.982531 1.935032 0.407443
H 3.171421 2.052285 -1.362565
H 5.604307 -1.644219 0.434619
H 5.782967 -1.530574 -1.328777
H 1.091065 0.513352 -1.579558
H 0.790692 2.149643 -0.978467
H 7.835820 -0.075824 -1.025199
H 7.658025 -0.194402 0.736533
H 9.383628 -1.849030 -0.096318
H 7.987958 -2.717004 0.606400
H 8.164080 -2.599344 -1.166616
H -1.183992 0.889276 -1.642218
H -0.926704 -0.349447 2.504510
H -3.614199 0.337835 -1.679216
H -3.375785 -0.913712 2.480737
H -5.364499 -1.011827 1.346665
H -7.392712 -2.095895 0.144075
H -8.096140 -0.869088 -0.955214
H -7.751924 -0.450834 0.753687


