%chk=000154571.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154571

0 1
 O  -2.2299999E-02 -3.6400001E-02   1.690100    
 N   0.3691000      5.7700001E-02  0.4759000    
 N  -0.3754000     -6.8400003E-02 -0.5578000    
 N    4.963000      -1.422300     -0.3454000    
 N   -4.965900       1.435700      8.3700001E-02
 C    2.669500     -0.6913000      6.4499997E-02
 C    1.772400      0.3455000      0.2144000    
 C   -2.662100      0.6941000     -0.2392000    
 C   -1.735200     -0.3410000     -0.3629000    
 C    4.009100     -0.3931000     -0.1854000    
 C   -4.012100      0.4019000     -4.5100000E-02
 C    2.155600       1.668500      0.1253000    
 C    2.223700      -2.116600      0.1664000    
 C    4.421900      0.9360000     -0.2798000    
 C   -2.158400      -1.668300     -0.2926000    
 C    3.495000       1.966700     -0.1244000    
 C   -2.204200       2.117200     -0.3145000    
 C   -4.435200     -0.9253000      2.5300000E-02
 C   -3.508500      -1.960400     -9.8499998E-02
 H    1.438300       2.474700      0.2462000    
 H    2.804900      -2.642400      0.9322000    
 H    1.174900      -2.239300      0.4472000    
 H    2.357900      -2.621800     -0.7963000    
 H    5.462600       1.182800     -0.4740000    
 H   -1.444600      -2.482300     -0.3885000    
 H    3.816200       3.001600     -0.1978000    
 H   -2.802100       2.676200      -1.043000    
 H   -2.294100       2.593500      0.6674000    
 H   -1.166100       2.227600     -0.6399000    
 H   -5.484100      -1.167400      0.1764000    
 H   -3.837900      -2.993800     -4.3900002E-02
 H    5.928700      -1.183100     -0.5293000    
 H    4.695100      -2.395400     -0.3041000    
 H   -4.689800       2.407300      7.7900000E-02
 H   -5.939300       1.200300      0.2279000    


%chk=000154571-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154571

0 1
O -0.024247 -0.243522 1.266831
N 0.323350 -0.087799 0.000710
N -0.476539 -0.092166 -1.056070
N 5.139214 -0.991516 0.726053
N -4.848936 1.105667 1.011795
C 2.743074 -0.613646 0.383132
C 1.753135 0.135272 -0.299499
C -2.650793 0.596925 0.044631
C -1.890209 -0.219053 -0.844302
C 4.111696 -0.292207 0.089274
C -4.060712 0.356268 0.130327
C 2.053851 1.137854 -1.250316
C 2.455263 -1.751946 1.343740
C 4.428736 0.728303 -0.850994
C -2.513754 -1.176077 -1.692846
C 3.405747 1.427345 -1.518431
C -2.035349 1.734738 0.832137
C -4.673390 -0.634731 -0.687535
C -3.902599 -1.381521 -1.600675
H 1.238702 1.657143 -1.758531
H 2.772932 -1.496145 2.374709
H 1.384735 -1.987589 1.398428
H 3.002498 -2.665213 1.033907
H 5.480353 0.963197 -1.055902
H -1.890925 -1.744522 -2.388924
H 3.662632 2.206219 -2.244063
H -2.710712 2.612311 0.855075
H -1.800889 1.431126 1.870841
H -1.086447 2.071497 0.383715
H -5.754873 -0.802929 -0.611217
H -4.387919 -2.129014 -2.237705
H 6.109850 -0.783032 0.512940
H 4.940843 -1.692904 1.431677
H -4.428260 1.720023 1.700702
H -5.849457 0.940342 1.064785


