%chk=000096029.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096029

0 1
 O   -3.750800      0.6178000      7.9999998E-04
 O   -3.185600      -1.503300     -9.9999997E-05
 N    1.766800      -1.537900     -9.9999997E-05
 N    2.500000       1.142100      1.9999999E-04
 N   -2.880100     -0.2861000      1.9999999E-04
 C   0.8322000     -0.5713000     -9.9999997E-05
 C    1.203400      0.7858000     -9.9999997E-05
 C   -1.508500      7.9400003E-02 -3.0000001E-04
 C  -0.5205000     -0.9036000     -1.9999999E-04
 C   0.2082000       1.760400     -1.9999999E-04
 C   -1.142600       1.417100     -5.0000002E-04
 C    3.058000      -1.160800      9.9999997E-05
 C    3.419400      0.1602000      3.9999999E-04
 H  -0.7844000      -1.960300       0.000000    
 H   0.4817000       2.813700     -1.9999999E-04
 H   -1.875400       2.219500     -5.0000002E-04
 H    3.789600      -1.958700      3.0000001E-04
 H    4.455300      0.4746000      6.0000003E-04


%chk=000096029-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096029

0 1
O -3.798507 0.667640 -0.000089
O -3.247889 -1.545949 -0.000232
N 1.795695 -1.600273 0.000182
N 2.553385 1.192030 0.000025
N -2.937727 -0.294647 -0.000057
C 0.836634 -0.590658 0.000086
C 1.215391 0.809595 0.000013
C -1.493319 0.070459 -0.000024
C -0.542925 -0.950743 0.000061
C 0.199765 1.816734 -0.000079
C -1.146159 1.457614 -0.000092
C 3.079573 -1.196825 0.000199
C 3.456136 0.192651 0.000108
H -0.834634 -2.003742 0.000104
H 0.517157 2.863446 -0.000135
H -1.946864 2.200966 -0.000144
H 3.847174 -1.978264 0.000259
H 4.513814 0.478566 0.000116


