%chk=000115440.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115440

0 1
 O   0.8367000      -1.584800       1.864900    
 O    2.317200      0.4252000      0.2517000    
 O    2.455900      -1.658500     -0.7477000    
 N  -0.4752000     -0.8140000      9.5799997E-02
 N   -2.283400       1.386300      8.0200002E-02
 C   -1.799100      -1.000100      0.6571000    
 C  -0.6737000     -8.5000001E-02  -1.147000    
 C   -2.604400      -1.454100     -0.5684000    
 C   -1.856300     -0.8415000      -1.771400    
 C   -2.262200      0.3840000       1.166500    
 C   -1.063200       1.358600     -0.7541000    
 C   0.6942000      -1.119300      0.7434000    
 C   -2.549700       2.725700      0.5934000    
 C    1.933100     -0.8418000     -2.1299999E-02
 C    3.509700      0.8457000     -0.4191000    
 C    3.820200       2.273700     -2.4000000E-02
 H   -1.799900      -1.735700       1.467300    
 H   0.2121000     -8.8600002E-02  -1.787500    
 H   -3.655400      -1.150900     -0.5281000    
 H   -2.578300      -2.547300     -0.6522000    
 H   -1.488100      -1.652300      -2.411700    
 H   -2.498900     -0.2021000      -2.385000    
 H   -3.268300      0.2910000       1.592300    
 H   -1.587900      0.7121000       1.969100    
 H  -0.2264000       1.820600     -0.2137000    
 H   -1.235600       1.943400      -1.665300    
 H   -2.643800       3.441800     -0.2303000    
 H   -1.757200       3.074600       1.265000    
 H   -3.498900       2.746800       1.140000    
 H    4.341400      0.1929000     -0.1309000    
 H    3.359300      0.7865000      -1.502900    
 H    4.727300       2.628700     -0.5210000    
 H    2.989200       2.935700     -0.2891000    
 H    3.956200       2.352800       1.059600    


%chk=000115440-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000115440

0 1
O 0.712725 -1.909455 1.842003
O 2.307764 0.392477 0.090175
O 2.770667 -1.827484 -0.478111
N -0.450955 -0.834698 0.123829
N -2.272081 1.377121 0.150056
C -1.826251 -1.012886 0.659824
C -0.629924 -0.007134 -1.097751
C -2.625828 -1.387091 -0.622650
C -1.827340 -0.719567 -1.795822
C -2.262491 0.360941 1.232842
C -1.005773 1.421292 -0.622142
C 0.687295 -1.266773 0.746758
C -2.715785 2.704568 0.607027
C 2.011538 -0.971415 0.021459
C 3.659697 0.800513 -0.421969
C 3.753689 2.312734 -0.253585
H -1.826281 -1.783317 1.446314
H 0.287162 0.020900 -1.707136
H -3.656524 -1.000950 -0.565524
H -2.662632 -2.483731 -0.740479
H -1.456978 -1.478634 -2.506606
H -2.446849 0.007998 -2.345216
H -3.284569 0.286871 1.650218
H -1.569589 0.629405 2.069045
H -0.148654 1.823806 -0.027041
H -1.155635 2.082007 -1.497493
H -2.803434 3.386094 -0.258617
H -2.021548 3.175246 1.347614
H -3.711526 2.621881 1.079158
H 4.421469 0.257207 0.165262
H 3.742752 0.480240 -1.476272
H 4.738766 2.667130 -0.608092
H 2.970577 2.826397 -0.837677
H 3.643147 2.598406 0.806198


