%chk=000030230.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030230

0 1
 O   -6.251000       1.010300      0.1460000    
 O   -4.607500       2.541200     -0.2034000    
 N    5.606300      0.3650000     -0.1804000    
 N   0.1119000     -0.3635000      0.6116000    
 N  -0.4631000     -0.5198000     -0.4910000    
 C    4.222000      0.1817000      1.8900000E-02
 C    3.367800       1.284300      3.7000000E-02
 C    3.707200      -1.102300      0.1982000    
 C    1.491000     -0.1800000      0.4125000    
 C    1.998800       1.103000      0.2344000    
 C    2.338300      -1.283600      0.3954000    
 C    6.256400       1.582800      0.2608000    
 C    6.399200     -0.6683000     -0.8166000    
 C   -1.835600     -0.7027000     -0.2924000    
 C   -4.059700      0.2157000     -7.5800002E-02
 C   -2.691100      0.3990000     -0.2737000    
 C   -2.348800      -1.987400     -0.1131000    
 C   -4.572700      -1.069000      0.1032000    
 C   -3.717400      -2.170500      8.4500000E-02
 C   -4.952000       1.364000     -5.6000002E-02
 H    3.734400       2.296100     -0.1112000    
 H    4.345800      -1.981100      0.2020000    
 H    1.339800       1.967000      0.2453000    
 H    1.945500      -2.286800      0.5376000    
 H    6.081500       2.396000     -0.4514000    
 H    7.340500       1.445200      0.3429000    
 H    5.902500       1.890400       1.251300    
 H    7.344000     -0.2634000      -1.196300    
 H    5.876400      -1.103800      -1.675800    
 H    6.644400      -1.463300     -0.1045000    
 H   -2.280800       1.396300     -0.4152000    
 H   -1.690500      -2.852100     -0.1268000    
 H   -5.631100      -1.257100      0.2602000    
 H   -4.116300      -3.171100      0.2237000    
 H   -6.844400       1.791400      0.1570000    


%chk=000030230-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030230

0 1
O -6.147432 -0.474498 1.794519
O -4.162607 -0.366931 2.991274
N 5.737350 0.250373 -0.037415
N 0.078103 -0.084296 0.183702
N -0.603335 -0.096945 -0.941721
C 4.347225 0.168636 -0.008871
C 3.581029 0.156467 -1.227562
C 3.632416 0.093866 1.233248
C 1.483054 0.001438 0.037779
C 2.186796 0.074911 -1.202829
C 2.234438 0.012801 1.246178
C 6.452215 0.316258 -1.321225
C 6.502039 0.257139 1.218705
C -2.022867 -0.183674 -0.759545
C -4.092513 -0.327239 0.543332
C -2.682985 -0.243074 0.496667
C -2.790206 -0.208406 -1.955516
C -4.857601 -0.352851 -0.656159
C -4.197855 -0.292849 -1.901488
C -4.744248 -0.387296 1.879890
H 4.090313 0.212130 -2.193731
H 4.172333 0.098403 2.183480
H 1.607009 0.065736 -2.131210
H 1.684974 -0.044628 2.191895
H 6.260243 -0.580188 -1.943823
H 7.535520 0.372767 -1.133453
H 6.160874 1.210697 -1.906979
H 7.576775 0.334613 0.993225
H 6.340592 -0.672001 1.801070
H 6.224902 1.116969 1.860477
H -2.098063 -0.223450 1.420816
H -2.255867 -0.160437 -2.910324
H -5.947078 -0.418353 -0.594532
H -4.779354 -0.311558 -2.829198
H -6.514490 -0.510929 2.718227


