%chk=000022363.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022363

0 1
 O    4.070100      0.9133000      6.6799998E-02
 O    1.098100      -2.989700     -0.5448000    
 O  -0.9084000      -2.162000     -0.8733000    
 N   0.3174000      -2.015400     -0.6566000    
 N   -1.360800      0.2780000     -0.8959000    
 N   -1.980800      0.2095000      0.1878000    
 N   -4.345700      -1.353400       1.989300    
 N   -4.424000       2.485600     -0.1725000    
 C    2.739400      0.7503000     -0.1676000    
 C   0.8406000     -0.6982000     -0.5325000    
 C    2.204200     -0.5318000     -0.2908000    
 C   1.2100000E-02  0.4177000     -0.6510000    
 C    1.910900       1.866200     -0.2861000    
 C   0.5471000       1.699900     -0.5276000    
 C    4.730600     -0.1152000      0.8030000    
 C    5.886400      0.4915000       1.569600    
 C   -3.421300      6.3800000E-02 -1.8400000E-02
 C   -3.936000     -0.7257000       1.103200    
 C   -3.979800       1.415700     -0.1027000    
 H    2.853700      -1.400500     -0.2314000    
 H    2.322200       2.867400     -0.1913000    
 H  -8.9100003E-02   2.576500     -0.6195000    
 H    4.063100     -0.5868000       1.535300    
 H    5.106600     -0.8725000      0.1062000    
 H    6.423300     -0.2726000       2.138600    
 H    6.588200      0.9803000      0.8858000    
 H    5.528700       1.261400       2.261500    
 H   -3.632500     -0.4782000     -0.9499000    


%chk=000022363-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022363

0 1
O 3.969138 0.991400 0.802836
O 1.388313 -2.970728 -1.182525
O -0.644607 -2.720851 -0.167687
N 0.515271 -2.283764 -0.519460
N -1.438943 -0.171007 -0.343600
N -2.340758 0.580167 0.207799
N -5.454427 -0.212724 1.542022
N -4.399068 2.326688 -1.964605
C 2.660063 0.624892 0.545011
C 0.893881 -0.904744 -0.122555
C 2.259847 -0.659717 0.097057
C -0.098955 0.096621 0.063943
C 1.682588 1.638915 0.760075
C 0.331105 1.377323 0.518635
C 5.048550 -0.006889 0.565253
C 6.366184 0.685629 0.891928
C -3.710139 0.258680 -0.421854
C -4.684003 0.012019 0.662032
C -4.113143 1.403658 -1.267389
H 2.965929 -1.474468 -0.075852
H 2.020247 2.620439 1.104436
H -0.424301 2.158304 0.648589
H 4.873257 -0.882710 1.220899
H 5.007328 -0.331341 -0.493263
H 7.205067 -0.016031 0.735521
H 6.519959 1.563019 0.241773
H 6.383683 1.020627 1.942545
H -3.617768 -0.648306 -1.056363


