%chk=000085300.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085300

0 1
 O    3.134500     -0.4325000      3.0000001E-04
 O   -2.750600       1.702800      6.0000003E-04
 O   -3.155600     -0.4547000     -3.0000001E-04
 N   -1.348300      -2.164400       0.000000    
 N   -2.358700      0.5125000      9.9999997E-05
 C  -0.4708000      -1.056400     -9.9999997E-05
 C  -0.9600000      0.2499000     -3.9999999E-04
 C    1.791800     -0.2091000      1.9999999E-04
 C   0.9051000      -1.286000      1.9999999E-04
 C  -7.3399998E-02   1.326700     -3.9999999E-04
 C    1.302400       1.097200     -9.9999997E-05
 C    3.983500      0.7141000     -9.9999997E-05
 H    1.294600      -2.301400      3.9999999E-04
 H  -0.4149000       2.358800     -5.0000002E-04
 H    1.934700       1.978600     -1.9999999E-04
 H   -2.350700      -2.053600      7.9999998E-04
 H  -0.9618000      -3.099800      6.0000003E-04
 H    3.854400       1.310900      0.9092000    
 H    3.854300       1.310200     -0.9099000    
 H    5.016600      0.3513000       0.000000    


%chk=000085300-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085300

0 1
O 3.141655 -0.444735 0.000190
O -2.838961 1.760256 0.000230
O -3.288175 -0.472652 0.001111
N -1.310164 -2.210115 0.000200
N -2.436762 0.528824 -0.000153
C -0.493502 -1.104266 0.000150
C -1.012970 0.247189 -0.000145
C 1.779520 -0.143499 0.000057
C 0.922566 -1.256536 0.000273
C -0.129847 1.358093 -0.000358
C 1.255921 1.187847 -0.000280
C 4.100926 0.667300 -0.000062
H 1.366145 -2.257027 0.000493
H -0.576389 2.355891 -0.000566
H 1.912558 2.060406 -0.000462
H -2.324350 -2.049269 -0.000349
H -0.909010 -3.144649 0.000431
H 3.989137 1.292811 0.905508
H 3.989171 1.292367 -0.905942
H 5.089630 0.186863 0.000075


