%chk=000082195.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082195

0 1
 O    3.984300      0.2258000     -5.0000002E-04
 O   -4.901000      -2.218400     -7.9999998E-04
 O    3.268400      -2.002900      2.0000001E-03
 N   -1.329300       1.826000      6.0000003E-04
 C   1.4500000E-02   1.422000      1.9999999E-04
 C   -2.200800      0.8682000      5.0000002E-04
 C    2.681400      0.6197000     -3.9999999E-04
 C   0.6777000       1.223100      -1.208000    
 C   0.6778000       1.222000       1.207900    
 C    2.013300      0.8213000      -1.208200    
 C    2.013600      0.8201000       1.207700    
 C   -1.758400     -0.5463000     -7.9999998E-04
 C   -3.659700       1.117600      7.9999998E-04
 C   -2.638400      -1.549700     -1.0000000E-03
 C   -4.538100      0.1126000      6.9999998E-04
 C   -4.093500      -1.295900       0.000000    
 C    4.162700      -1.167300     -1.9999999E-04
 C    5.625700      -1.497900     -3.9999999E-04
 H   0.1660000       1.379000      -2.154000    
 H   0.1664000       1.376900       2.154200    
 H    2.527700      0.6673000      -2.153000    
 H    2.528100      0.6654000       2.152300    
 H  -0.7168000     -0.8392000     -1.6000000E-03
 H   -3.995200       2.148800      1.3000000E-03
 H   -2.309200      -2.582900     -1.9000000E-03
 H   -5.605200      0.3044000      1.0000000E-03
 H    6.094900      -1.095300      0.9006000    
 H    5.752300      -2.584200     -5.7000001E-03
 H    6.096600      -1.087100     -0.8968000    


%chk=000082195-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000082195

0 1
O 4.191166 0.238505 -0.001212
O -5.674243 -1.842186 0.003259
O 3.854576 -2.085734 -0.003342
N -1.330245 1.537793 -0.001552
C 0.035763 1.128499 -0.001564
C -2.330765 0.668953 -0.000616
C 2.779453 0.496266 -0.001397
C 0.735405 0.980882 -1.229785
C 0.733964 0.975202 1.226801
C 2.108298 0.660326 -1.228212
C 2.106909 0.654856 1.225371
C -2.176231 -0.803343 0.000466
C -3.698710 1.221901 -0.000042
C -3.273959 -1.621271 0.001473
C -4.797253 0.405291 0.001011
C -4.656670 -1.072323 0.001312
C 4.632766 -1.115739 -0.002749
C 6.143709 -1.144685 0.001356
H 0.200828 1.123241 -2.174009
H 0.198294 1.113242 2.171053
H 2.653597 0.535955 -2.168753
H 2.651135 0.526352 2.165981
H -1.159559 -1.211597 0.000328
H -3.777179 2.313986 -0.000488
H -3.186391 -2.713539 0.002235
H -5.818840 0.799786 0.001502
H 6.528965 -0.621344 0.893392
H 6.496724 -2.185389 -0.003360
H 6.534295 -0.610785 -0.881958


