%chk=000108113.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108113

0 1
 O   -4.752700     -0.6135000      5.0000002E-04
 O   -3.265300      -2.228100     -3.0000001E-04
 N   -3.566400      -1.013100      1.9999999E-04
 N    3.371600      -2.808000      1.9999999E-04
 C  -0.1726000      0.5941000     -9.9999997E-05
 C    1.199100      0.2388000     -9.9999997E-05
 C   -1.164000     -0.4146000     -9.9999997E-05
 C    1.576300      -1.124400       0.000000    
 C  -0.5497000       1.957200       0.000000    
 C    2.190700       1.247500       0.000000    
 C  -0.7716000      -1.759900     -9.9999997E-05
 C   0.5801000      -2.110000     -9.9999997E-05
 C   -2.517400     -4.6799999E-02 -9.9999997E-05
 C    2.938100      -1.459800       0.000000    
 C   0.4465000       2.942900      9.9999997E-05
 C    1.798200       2.592800       0.000000    
 C   -1.911500       2.292600       0.000000    
 C    3.544000      0.8797000      9.9999997E-05
 C   -2.887100       1.297100     -9.9999997E-05
 C    3.913700     -0.4643000       0.000000    
 H   -1.372100      -2.652000     -9.9999997E-05
 H   0.8111000      -3.171300       0.000000    
 H   0.1802000       3.998000      9.9999997E-05
 H    2.543200       3.386000      9.9999997E-05
 H   -2.224500       3.334700       0.000000    
 H    4.323900       1.638200      1.9999999E-04
 H   -3.925700       1.618600     -9.9999997E-05
 H    4.970400     -0.7205000      9.9999997E-05
 H    4.364300      -3.005500     -9.9999997E-05
 H    2.726100      -3.582600     -7.9999998E-04


%chk=000108113-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108113

0 1
O -4.912743 -0.477024 0.000546
O -3.513996 -2.265898 -0.000316
N -3.715069 -0.981804 -0.000150
N 3.471958 -2.810990 -0.000107
C -0.178678 0.561780 -0.000032
C 1.222592 0.214471 -0.000016
C -1.196752 -0.475760 -0.000097
C 1.628071 -1.167265 -0.000047
C -0.553261 1.959870 0.000014
C 2.219078 1.258921 0.000038
C -0.750260 -1.850105 -0.000099
C 0.599708 -2.167901 -0.000064
C -2.572364 -0.050688 -0.000094
C 3.032807 -1.495979 -0.000057
C 0.465120 2.976875 0.000065
C 1.808627 2.635404 0.000078
C -1.934442 2.309733 0.000014
C 3.596267 0.894614 0.000051
C -2.922315 1.324913 -0.000026
C 3.996846 -0.444853 0.000001
H -1.501434 -2.637856 -0.000144
H 0.861784 -3.232692 -0.000038
H 0.154014 4.027134 0.000097
H 2.580907 3.413436 0.000119
H -2.217486 3.367729 0.000042
H 4.354156 1.686487 0.000094
H -3.983856 1.581732 -0.000015
H 5.063435 -0.698843 -0.000001
H 4.467333 -3.016957 -0.000111
H 2.826851 -3.594684 -0.000247


