%chk=000071268.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071268

0 1
 O   0.1188000       2.800000     -0.1864000    
 O   -1.167200      -1.427900      0.9555000    
 O    1.342900      -1.504100      0.2627000    
 O   -2.135400       2.522100     -4.1600000E-02
 N   -2.758700     -0.3183000     -0.2901000    
 N    3.069400      4.3000001E-03  1.6500000E-02
 N   -1.020500       1.955000     -2.5699999E-02
 N    1.245200       1.986700     -0.1404000    
 C   -3.769900      -1.344200     -0.1713000    
 C    4.123700     -0.9797000      5.6299999E-02
 C  -0.6003000      0.6979000      0.1103000    
 C   0.7728000      0.7714000      3.3799998E-02
 C   -4.641000      -1.376100      -1.420400    
 C   -4.609000      -1.125100       1.081500    
 C   -1.481600     -0.4152000      0.2921000    
 C    5.378700     -0.3860000      0.6827000    
 C    4.405800      -1.517800      -1.341000    
 C    1.726500     -0.3429000      0.1256000    
 H   -3.264500      -2.313000     -8.0899999E-02
 H    3.791600      -1.815300      0.6843000    
 H   -3.003800      0.5394000     -0.7773000    
 H    3.318100      0.9753000     -0.1516000    
 H   -5.388300      -2.173700      -1.356700    
 H   -5.167400     -0.4258000      -1.563500    
 H   -4.031900      -1.552800      -2.313800    
 H   -3.982200      -1.135500       1.979800    
 H   -5.365200      -1.909600       1.188700    
 H   -5.122400     -0.1575000       1.050600    
 H    6.174800      -1.134800      0.7504000    
 H    5.754800      0.4599000      9.6500002E-02
 H    5.171400     -1.9400001E-02   1.694100    
 H    3.509100      -1.974300      -1.774200    
 H    5.192800      -2.278600      -1.316100    
 H    4.726000     -0.7170000      -2.017100    


%chk=000071268-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000071268

0 1
O 0.180119 3.003802 -0.938576
O -0.924905 -1.229829 0.713747
O 1.449657 -1.332880 -1.314343
O -2.300250 2.572934 -0.773660
N -2.780745 -0.329611 -0.392111
N 2.937219 -0.096043 0.006575
N -1.147681 2.052728 -0.719790
N 1.256565 2.130434 -0.842800
C -3.727096 -1.384709 0.051904
C 4.025217 -1.103605 -0.007498
C -0.631896 0.820144 -0.507380
C 0.803783 0.881207 -0.604843
C -4.870158 -1.499338 -0.974224
C -4.240450 -1.094314 1.482097
C -1.460063 -0.341866 -0.014445
C 4.832078 -0.999151 1.300817
C 4.910818 -0.938434 -1.265423
C 1.751133 -0.291802 -0.658683
H -3.146672 -2.325610 0.074101
H 3.522693 -2.087058 -0.060983
H -3.153490 0.472050 -0.911541
H 3.102109 0.802501 0.467995
H -5.561236 -2.307249 -0.678144
H -5.456600 -0.561495 -1.027310
H -4.482303 -1.729508 -1.982230
H -3.394548 -1.020440 2.186422
H -4.901432 -1.912148 1.821771
H -4.813480 -0.149390 1.512292
H 5.620157 -1.771734 1.321427
H 5.329890 -0.013454 1.386125
H 4.183238 -1.143810 2.182525
H 4.298227 -1.014457 -2.179880
H 5.679627 -1.731722 -1.297660
H 5.423574 0.041257 -1.262972


