%chk=000138939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138939

0 1
 O   -2.194400      -2.223000      1.7000000E-03
 O  -5.2999998E-03  -2.386300     -3.5999999E-03
 N   -1.054700      -1.700500     -9.9999997E-05
 C    1.565400     -0.4468000     -7.1999999E-03
 C   0.2973000      0.3446000     -2.4999999E-03
 C    2.807800      0.4526000     -1.2100000E-02
 C  -0.9490000     -0.2822000      1.2000001E-03
 C   0.3774000       1.737200     -3.0000000E-03
 C    4.093500     -0.3585000      1.6899999E-02
 C   -2.114800      0.4837000      4.4999998E-03
 C  -0.7885000       2.502900      1.9999999E-04
 C   -2.034600       1.876300      3.8999999E-03
 H    1.632100      -1.062000      0.8983000    
 H    1.627700      -1.063700     -0.9116000    
 H    2.836100       1.078700     -0.9128000    
 H    2.824700       1.104800      0.8702000    
 H    1.301400       2.302500     -8.9999996E-03
 H    4.145900     -0.9798000      0.9168000    
 H    4.163400      -1.014100     -0.8570000    
 H    4.963000      0.3064000      1.2600000E-02
 H   -3.104300      3.3700000E-02  7.1999999E-03
 H  -0.7277000       3.587500     -1.0000000E-03
 H   -2.942000       2.473100      6.0999999E-03


%chk=000138939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138939

0 1
O -2.345155 -2.204723 0.007627
O -0.093390 -2.488646 0.006378
N -1.141028 -1.730875 0.005045
C 1.649042 -0.384347 0.002390
C 0.321791 0.371178 -0.000014
C 2.927520 0.481302 0.001613
C -0.968895 -0.250790 0.001377
C 0.312670 1.792962 -0.003821
C 4.194985 -0.400407 0.005167
C -2.174354 0.493739 -0.000789
C -0.878586 2.547972 -0.006169
C -2.133390 1.897733 -0.004631
H 1.670870 -1.067199 0.873707
H 1.672140 -1.070509 -0.866345
H 2.944178 1.139723 -0.890076
H 2.942108 1.144133 0.890065
H 1.268060 2.323068 -0.004918
H 4.224103 -1.050559 0.899393
H 4.225222 -1.055876 -0.885128
H 5.112177 0.215717 0.003916
H -3.120781 -0.052450 0.000508
H -0.825033 3.642121 -0.009206
H -3.063853 2.473834 -0.006391


