%chk=000076952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076952

0 1
 O    1.972700     -0.7024000     -0.5929000    
 O   -4.052800     -0.1051000      -1.335900    
 N   -5.642700      0.5260000      0.1992000    
 C    4.284500     -0.2714000     -0.1429000    
 C    5.342600      0.7973000      0.1157000    
 C    2.910800      0.3420000     -0.3739000    
 C   0.6770000     -0.4589000     -0.2173000    
 C   -1.950600      3.4200002E-02  0.5450000    
 C    6.704300      0.1788000      0.3886000    
 C   -3.359800      0.2986000      0.9541000    
 C  -0.1289000      -1.513700      0.1950000    
 C   0.1830000      0.8400000     -0.2525000    
 C   -1.447400      -1.266300      0.5775000    
 C   -1.135400       1.087400      0.1301000    
 C   -4.357300      0.2134000     -0.1899000    
 H    4.563300     -0.8801000      -1.012200    
 H    4.232500     -0.9664000      0.7047000    
 H    5.050900       1.411500      0.9757000    
 H    5.416400       1.465500     -0.7501000    
 H    2.656200      0.9357000      0.5139000    
 H    2.934400      0.9947000      -1.254300    
 H    6.671700     -0.4686000       1.270700    
 H    7.041600     -0.4189000     -0.4643000    
 H    7.447100      0.9620000      0.5694000    
 H   -3.666600     -0.4143000       1.730300    
 H   -3.437100       1.294800       1.408600    
 H   -2.072800      -2.095700      0.8970000    
 H   -1.518700       2.103700      9.2900001E-02
 H   0.2592000      -2.527800      0.2215000    
 H   0.7748000       1.682700     -0.5963000    
 H   -5.872500      0.7841000       1.153500    
 H   -6.408500      0.5071000     -0.4660000    


%chk=000076952-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000076952

0 1
O 1.879194 -0.718296 0.177688
O -5.894693 0.469676 0.114149
N -4.009117 0.347201 -1.236421
C 4.215610 -0.177211 -0.139976
C 5.306968 0.916702 -0.206667
C 2.833906 0.407610 0.158895
C 0.532332 -0.433750 0.441273
C -2.253445 -0.087072 0.968010
C 6.705855 0.333307 -0.500037
C -3.737622 0.096866 1.227093
C -0.336671 -1.554727 0.455421
C 0.013246 0.862212 0.689801
C -1.707579 -1.377022 0.715589
C -1.367683 1.018690 0.950023
C -4.643630 0.319944 -0.009591
H 4.172996 -0.726802 -1.099879
H 4.470060 -0.916898 0.643011
H 5.333521 1.473260 0.752526
H 5.043426 1.655603 -0.990782
H 2.823577 0.919692 1.144124
H 2.532741 1.136451 -0.623126
H 7.005967 -0.388400 0.282515
H 6.718309 -0.198656 -1.469630
H 7.472932 1.127801 -0.539923
H -4.162834 -0.779521 1.750129
H -3.922983 0.963304 1.888542
H -2.367554 -2.252955 0.730494
H -1.759945 2.023662 1.149019
H 0.085395 -2.546858 0.268111
H 0.662961 1.742092 0.691920
H -3.000277 0.222506 -1.314072
H -4.573061 0.491491 -2.073326


