%chk=000144404.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000144404

0 1
 O   -2.513500     -0.2807000      -2.295900    
 O   -2.662600      0.9602000       2.152600    
 O    2.054100      -1.546500      0.7307000    
 N   -2.284900      0.5283000     -0.1136000    
 N   4.5499999E-02  0.3110000      7.1800001E-02
 C   -4.174200     -0.7396000     -0.6132000    
 C   -4.225700     -0.3293000      0.8490000    
 C   -1.020500       1.224800     -0.2553000    
 C   -2.898900     -0.1494000      -1.142400    
 C   -2.974700      0.4688000       1.076600    
 C    1.389400      0.6420000      3.5999999E-03
 C    2.394300     -0.2879000      0.3333000    
 C    1.784400       1.931000     -0.4024000    
 C    3.743500      5.8600001E-02  0.2596000    
 C    3.133600       2.277300     -0.4761000    
 C    4.113100       1.341200     -0.1450000    
 C    2.537100      -2.628600     -6.2300000E-02
 C    1.560000      -3.781300      2.8899999E-02
 H   -5.026200     -0.3391000      -1.170500    
 H   -4.149900      -1.828000     -0.7211000    
 H   -4.232500      -1.202400       1.508300    
 H   -5.102600      0.2902000       1.059200    
 H  -0.9328000       1.570000      -1.291200    
 H   -1.016900       2.082900      0.4257000    
 H  -0.1995000     -0.6272000      0.3670000    
 H    1.057100       2.693400     -0.6684000    
 H    4.518100     -0.6566000      0.5225000    
 H    3.422100       3.276200     -0.7903000    
 H    5.163500       1.611700     -0.2004000    
 H    2.644100      -2.329600      -1.112400    
 H    3.515900      -2.940100      0.3184000    
 H    1.905600      -4.634900     -0.5608000    
 H    1.433500      -4.098500       1.069400    
 H   0.5721000      -3.477900     -0.3332000    


%chk=000144404-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000144404

0 1
O -2.827292 -1.740742 -0.791005
O -2.224501 2.807829 0.155543
O 1.946699 -1.816020 -0.705361
N -2.292732 0.538864 -0.508248
N -0.029025 -0.144098 -1.218860
C -3.968174 -0.335447 0.946353
C -3.770949 1.169542 1.251774
C -1.223747 0.575616 -1.560883
C -2.997545 -0.647674 -0.199351
C -2.690064 1.648665 0.273938
C 0.991625 0.341936 -0.384877
C 2.084208 -0.542903 -0.107481
C 1.016346 1.641724 0.178836
C 3.167132 -0.133663 0.692195
C 2.110602 2.053072 0.977341
C 3.183589 1.176217 1.235809
C 3.012318 -2.805306 -0.471023
C 2.617119 -4.076667 -1.217841
H -4.994203 -0.586108 0.627515
H -3.727942 -0.986925 1.803999
H -3.426704 1.363105 2.282073
H -4.684244 1.769466 1.098904
H -1.661263 0.125651 -2.467312
H -1.022232 1.646030 -1.739579
H 0.021014 -1.137197 -1.451333
H 0.183438 2.332851 0.011390
H 3.997751 -0.816143 0.896554
H 2.110873 3.063281 1.400694
H 4.027180 1.495726 1.856378
H 3.975038 -2.400084 -0.845246
H 3.106959 -2.990100 0.618968
H 3.386924 -4.856158 -1.071835
H 1.652911 -4.464185 -0.846579
H 2.520490 -3.880154 -2.299351


