%chk=000021119.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021119

0 1
 O   0.6537000      0.4487000     -1.1000000E-03
 O    4.118400     -2.6799999E-02  2.6000000E-03
 O    2.896200       1.796800     -6.9999998E-04
 N   -2.151400       1.180000     -6.9999998E-04
 N   -2.731700     -0.9268000      5.0000002E-04
 N    2.982400      0.5332000      5.0000002E-04
 N   -3.492100       1.230600      6.9999998E-04
 C  -0.3445000     -0.4733000     -1.1000000E-03
 C   -1.715100     -0.1036000     -6.0000003E-04
 C   0.1742000      -1.747200     -5.0000002E-04
 C    1.822600     -0.2440000     -7.9999998E-04
 C    1.581700      -1.598300     -3.9999999E-04
 C   -3.794500     -6.9300003E-02  1.6000000E-03
 H  -0.3818000      -2.674600       0.000000    
 H    2.322700      -2.385100      3.0000001E-04
 H   -1.623300       2.045000     -1.5000000E-03
 H   -4.821500     -0.4025000      2.9000000E-03


%chk=000021119-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021119

0 1
O 0.606424 0.450213 -0.000073
O 4.150369 -0.087105 -0.000342
O 2.918954 1.859083 -0.000670
N -2.149806 1.199027 0.000036
N -2.848113 -0.931257 0.000510
N 3.031255 0.571276 -0.000384
N -3.536316 1.289103 0.000265
C -0.374476 -0.563833 0.000194
C -1.745479 -0.126026 0.000255
C 0.234081 -1.821094 0.000350
C 1.836600 -0.223165 -0.000098
C 1.650460 -1.602058 0.000129
C -3.900543 -0.031252 0.000396
H -0.294543 -2.770917 0.000578
H 2.443155 -2.345456 0.000161
H -1.580961 2.045496 -0.000176
H -4.945062 -0.329235 0.000570


