%chk=000048192.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048192

0 1
 O    5.410700      0.1480000      8.3300002E-02
 O  -0.9813000      4.9400002E-02  0.5182000    
 O   -1.901200       1.963300     -0.3855000    
 N    2.621900     -0.3540000     -0.1863000    
 C   -4.165700     -0.4094000     -8.3800003E-02
 C    3.125400      0.9133000      0.3613000    
 C    3.574100      -1.437600      9.4800003E-02
 C    1.303100     -0.6677000      0.3595000    
 C   -3.282700      0.4253000      0.8694000    
 C    4.506800       1.213000     -0.2136000    
 C    4.945400      -1.082400     -0.4728000    
 C   -5.462400     -0.7773000      0.6629000    
 C   -3.457600      -1.708600     -0.5022000    
 C   -4.538600      0.3946000      -1.340600    
 C   0.2956000      0.4054000     -2.1100000E-02
 C   -1.993700      0.9249000      0.2565000    
 H    3.186000      0.8621000       1.456100    
 H    2.495800       1.763800      8.8100001E-02
 H    3.232100      -2.373100     -0.3622000    
 H    3.658300      -1.598300       1.177600    
 H    1.329100     -0.7838000       1.451300    
 H   0.9481000      -1.627500     -3.7799999E-02
 H   -3.039800     -0.1459000       1.775100    
 H   -3.827800       1.310400       1.223400    
 H    4.469400       1.369300      -1.298700    
 H    4.909400       2.125300      0.2384000    
 H    5.669800      -1.860400     -0.2115000    
 H    4.922800      -1.004300      -1.566700    
 H   -5.247100      -1.361000       1.565100    
 H   -6.011700      0.1203000      0.9687000    
 H   -6.129000      -1.375600      3.1500001E-02
 H   -2.563300      -1.506100      -1.101000    
 H   -3.151500      -2.291600      0.3736000    
 H   -4.117800      -2.340100      -1.107800    
 H   -5.008300       1.348100      -1.074900    
 H   -3.661000      0.6110000      -1.958900    
 H   -5.246000     -0.1606000      -1.967400    
 H   0.2164000      0.4887000      -1.111800    
 H   0.5507000       1.380700      0.4019000    


%chk=000048192-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000048192

0 1
O 5.626373 0.041772 -0.050797
O -0.963310 0.041070 0.530823
O -1.953837 1.747065 -0.705550
N 2.737393 -0.271284 0.045770
C -4.318156 -0.419712 -0.156608
C 3.389801 1.008459 0.432885
C 3.648780 -1.413222 0.320677
C 1.395777 -0.451937 0.646795
C -3.333997 0.344598 0.803643
C 4.719543 1.169383 -0.322077
C 4.971689 -1.219410 -0.437678
C -5.465592 -0.988286 0.720354
C -3.578033 -1.586797 -0.860872
C -4.907263 0.549130 -1.214269
C 0.344458 0.375418 -0.102635
C -2.062202 0.813631 0.124866
H 3.586704 1.043397 1.534488
H 2.727374 1.856053 0.178366
H 3.165595 -2.348414 -0.019873
H 3.867351 -1.513350 1.413741
H 1.370982 -0.190546 1.732881
H 1.116848 -1.518318 0.563408
H -3.062936 -0.314951 1.645967
H -3.857051 1.234215 1.202136
H 4.520307 1.236315 -1.413320
H 5.260161 2.069813 0.013197
H 5.693528 -2.015116 -0.189967
H 4.774420 -1.218340 -1.531449
H -5.086320 -1.728640 1.450015
H -5.976213 -0.183033 1.281922
H -6.221153 -1.489856 0.087417
H -2.798892 -1.212128 -1.550517
H -3.090226 -2.254997 -0.127153
H -4.291144 -2.188289 -1.454678
H -5.497019 1.351250 -0.731453
H -4.112043 1.029933 -1.809334
H -5.578139 0.000304 -1.901515
H 0.314203 0.101296 -1.171511
H 0.506636 1.465126 -0.025995


