%chk=000167078.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167078

0 1
 O    3.458800      -1.159600     -2.2000000E-02
 O   -3.522000      -1.139200     -0.4861000    
 N    1.424900     -3.1300001E-02 -0.1489000    
 N   -1.500000     -2.5400000E-02 -0.1852000    
 C   0.6474000      -1.283400     -0.1315000    
 C  -0.7205000      -1.100100     -0.7994000    
 C   0.6659000       1.220200     -0.2856000    
 C  -0.7449000       1.138900      0.2895000    
 C   0.5174000      -1.836300       1.291700    
 C    2.819200     -0.1129000     -0.1364000    
 C   -2.883800     -0.1636000     -8.9000002E-02
 C    3.577000       1.146600     -0.2860000    
 C   -3.630100      0.9428000      0.5457000    
 C    4.766300       1.235700      0.2943000    
 C   -4.875500       1.167600      0.1489000    
 H    1.205600      -2.026600     -0.7156000    
 H  -0.5893000     -0.8242000      -1.853300    
 H   -1.284900      -2.038900     -0.7826000    
 H   0.6222000       1.441200      -1.359000    
 H    1.202400       2.040500      0.2006000    
 H  -0.7026000       1.066800       1.382600    
 H   -1.291700       2.054400      4.0399998E-02
 H    1.503000      -2.042600       1.722400    
 H   1.4000000E-02  -1.133100       1.962100    
 H  -4.9899999E-02  -2.772900       1.292800    
 H    3.173700       1.967900     -0.8639000    
 H   -3.169400       1.550500       1.313600    
 H    5.348700       2.146300      0.1967000    
 H    5.200600      0.4351000      0.8832000    
 H   -5.448800       1.972600      0.5974000    
 H   -5.366700      0.5849000     -0.6227000    


%chk=000167078-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167078

0 1
O 3.332882 -1.233737 0.309817
O -3.419618 -1.149219 -0.757623
N 1.423899 0.022874 -0.086426
N -1.476002 0.071682 -0.369943
C 0.623484 -1.245544 -0.103336
C -0.649109 -1.017805 -0.941514
C 0.700538 1.278638 -0.381963
C -0.744098 1.246283 0.157832
C 0.327115 -1.753931 1.325023
C 2.805376 -0.094046 0.079926
C -2.857879 -0.110304 -0.276910
C 3.642479 1.145838 -0.035708
C -3.642858 0.962402 0.419082
C 4.980148 1.090915 0.190282
C -4.995861 0.884304 0.494247
H 1.252189 -2.002436 -0.609036
H -0.376991 -0.784708 -1.990803
H -1.273822 -1.926112 -0.958080
H 0.676666 1.472628 -1.474776
H 1.207483 2.130280 0.099546
H -0.718101 1.230161 1.266996
H -1.237279 2.183448 -0.159317
H 1.272073 -1.873101 1.879462
H -0.332024 -1.061884 1.878139
H -0.173715 -2.738095 1.278596
H 3.179930 2.094054 -0.331412
H -3.115548 1.802776 0.884456
H 5.618118 1.976151 0.095393
H 5.444336 0.137953 0.469268
H -5.590782 1.646609 1.008722
H -5.516032 0.035825 0.034761


