%chk=000079246.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079246

0 1
 O   -2.887300      -1.699400      6.0000003E-04
 O    1.957300      -2.308300     -1.5000000E-03
 O    3.308300     -0.5781000     -7.9999998E-04
 N    2.155500      -1.070600     -1.9999999E-04
 C    1.205300       1.189200      3.0000001E-04
 C    1.034300     -0.1952000      1.5000000E-03
 C   -1.363500      0.1010000      6.0000003E-04
 C  -0.2500000     -0.7392000      1.7000000E-03
 C   9.1899998E-02   2.029500     -6.0000003E-04
 C   -1.192400       1.485400     -6.0000003E-04
 C    2.567300       1.804600      3.9999999E-04
 C   -2.702800     -0.4660000      1.9999999E-04
 C   -3.923900      0.4471000     -1.5000000E-03
 H  -0.3993000      -1.816400      2.2000000E-03
 H   0.2056000       3.110400     -1.5000000E-03
 H   -2.030700       2.175000     -1.5000000E-03
 H    3.126600       1.563900      0.9106000    
 H    3.126300       1.564700     -0.9100000    
 H    2.488700       2.899800      1.0000000E-03
 H   -3.934200       1.063200     -0.9043000    
 H   -3.935400       1.065100      0.9000000    
 H   -4.830100     -0.1672000     -1.4000000E-03


%chk=000079246-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000079246

0 1
O -2.885694 -1.767437 0.000020
O 1.857770 -2.414558 0.000624
O 3.371721 -0.720985 0.001350
N 2.156233 -1.159067 0.000662
C 1.272921 1.238600 -0.000063
C 1.035452 -0.172524 0.000155
C -1.395979 0.123142 -0.000741
C -0.262610 -0.720466 -0.000141
C 0.111560 2.058241 -0.000708
C -1.191968 1.527807 -0.001035
C 2.629906 1.910523 0.000333
C -2.765066 -0.509443 -0.001056
C -3.989483 0.397422 -0.000787
H -0.400553 -1.805575 0.000043
H 0.249368 3.144815 -0.000929
H -2.046475 2.212072 -0.001529
H 3.230540 1.615623 0.877951
H 3.231019 1.615642 -0.876985
H 2.506348 3.006468 0.000270
H -4.000985 1.051308 -0.892976
H -4.000146 1.052083 0.890844
H -4.896379 -0.225190 -0.000102


