%chk=000093489.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093489

0 1
 O    2.252000     -0.1977000      7.4900001E-02
 O   -2.417800       1.882400      0.1384000    
 O    5.587400      -1.239800     -6.1799999E-02
 O    3.734100      -2.333400      0.3722000    
 N   -2.820800     -0.3315000      0.7222000    
 N    4.328600      -1.254800      7.7000000E-02
 C   -4.989600     -0.5292000     -0.4431000    
 C   -4.253800     -0.2352000      0.8716000    
 C   -4.670200      -1.924800     -0.9814000    
 C   -6.501300     -0.3364000     -0.3115000    
 C   -2.022500      0.7437000      0.3660000    
 C  -0.5833000      0.3636000      0.2847000    
 C    1.782400       1.026700     -0.1362000    
 C   0.3354000       1.286600     -3.5799999E-02
 C    2.714800       1.942400     -0.4329000    
 C    3.594900     -7.9599999E-02 -9.5399998E-02
 C    3.929900       1.217200     -0.4090000    
 H   -4.638100      0.1910000      -1.194500    
 H   -4.505100      0.7701000       1.228200    
 H   -4.548100     -0.9512000       1.646900    
 H   -4.957700      -2.699600     -0.2626000    
 H   -5.211300      -2.113700      -1.914900    
 H   -3.602600      -2.037900      -1.195200    
 H   -6.925500      -1.036600      0.4160000    
 H   -7.001600     -0.4987000      -1.272000    
 H   -6.734500      0.6807000      2.0600000E-02
 H   -2.396800      -1.239600      0.8887000    
 H  -0.3073000     -0.6649000      0.4934000    
 H   2.9600000E-02   2.310800     -0.2374000    
 H    2.583400       2.994300     -0.6437000    
 H    4.923500       1.598700     -0.5979000    


%chk=000093489-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093489

0 1
O 2.309225 -0.176012 0.104242
O -2.466910 1.808918 0.155890
O 5.779539 -1.057584 -0.040718
O 3.923809 -2.332484 0.440490
N -2.820798 -0.432689 0.705285
N 4.500115 -1.219115 0.124518
C -5.054704 -0.547673 -0.492875
C -4.280016 -0.289577 0.830006
C -4.848951 -1.991227 -1.005035
C -6.553126 -0.238762 -0.274134
C -2.007131 0.638858 0.366506
C -0.553019 0.312832 0.281859
C 1.770966 1.112089 -0.139598
C 0.347695 1.293512 -0.033704
C 2.819432 1.993440 -0.451414
C 3.690326 -0.050961 -0.065777
C 4.042270 1.253163 -0.404420
H -4.655007 0.159581 -1.246396
H -4.475904 0.743762 1.167145
H -4.635928 -0.989644 1.610997
H -5.228847 -2.729031 -0.270831
H -5.394276 -2.152805 -1.952577
H -3.781758 -2.209477 -1.196283
H -6.987295 -0.904415 0.497389
H -7.125360 -0.390887 -1.207219
H -6.706488 0.807078 0.050140
H -2.400200 -1.353541 0.839423
H -0.213515 -0.712645 0.476626
H -0.042238 2.302509 -0.219406
H 2.703269 3.049715 -0.685032
H 5.052925 1.606672 -0.589598


