%chk=000121407.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121407

0 1
 O   0.5072000     -0.2720000     -0.8562000    
 O  -0.7943000       2.825800     -1.4600000E-02
 N    2.643400     -0.2630000     -3.6699999E-02
 N    1.171500       1.618200      0.1760000    
 C  -0.6081000      0.6155000     -0.9783000    
 C    1.479300      0.4224000     -0.1999000    
 C    3.788600      0.3292000      0.6471000    
 C    2.732300      -1.694200     -0.3076000    
 C   -1.810200     -6.0000001E-03 -0.3513000    
 C  -0.1231000       1.824500     -0.2256000    
 C    3.732700      8.0499999E-02   2.140200    
 C    3.077200      -1.964100      -1.757700    
 C   -1.657400      -1.001300      0.6141000    
 C   -3.087300      0.4082000     -0.7297000    
 C   -2.781600      -1.582500       1.200700    
 C   -4.211400     -0.1729000     -0.1429000    
 C   -4.058500      -1.168200      0.8223000    
 H  -0.7511000      0.8470000      -2.038400    
 H    4.719800     -8.4500000E-02  0.2412000    
 H    3.830500       1.407800      0.4544000    
 H    3.501600      -2.159200      0.3209000    
 H    1.796500      -2.201100     -4.2399999E-02
 H    2.822400      0.5045000       2.577100    
 H    3.745300     -0.9890000       2.372800    
 H    4.592900      0.5429000       2.634400    
 H    2.314700      -1.563500      -2.433100    
 H    4.033600      -1.502800      -2.025700    
 H    3.156500      -3.040900      -1.937000    
 H  -0.6800000      -1.341000      0.9441000    
 H   -3.218400       1.183600      -1.479900    
 H   -2.663000      -2.355400       1.954500    
 H   -5.205800      0.1499000     -0.4371000    
 H   -4.933900      -1.620000       1.279800    


%chk=000121407-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121407

0 1
O 0.479624 -0.527284 -0.911037
O -0.766303 2.827624 -0.428179
N 2.655236 -0.379821 -0.020107
N 1.195355 1.525239 -0.002976
C -0.683530 0.399728 -1.042761
C 1.485467 0.245270 -0.278438
C 3.748101 0.390046 0.632768
C 2.874346 -1.807992 -0.358264
C -1.911524 -0.128932 -0.320264
C -0.119404 1.755054 -0.457696
C 3.642325 0.367710 2.170516
C 3.555389 -1.995183 -1.730469
C -1.919115 -1.395660 0.311189
C -3.081605 0.673416 -0.296931
C -3.086443 -1.856088 0.962498
C -4.244212 0.208325 0.354549
C -4.252694 -1.058275 0.984767
H -0.871304 0.523566 -2.124668
H 4.705026 -0.048784 0.295418
H 3.693606 1.429753 0.269940
H 3.495459 -2.244484 0.445777
H 1.899888 -2.322745 -0.347507
H 2.707774 0.857338 2.492200
H 3.658973 -0.664380 2.565567
H 4.491009 0.918567 2.614813
H 2.913295 -1.604607 -2.538105
H 4.527621 -1.472259 -1.773353
H 3.736321 -3.068763 -1.919871
H -1.017362 -2.014667 0.286475
H -3.066602 1.665400 -0.761061
H -3.084368 -2.838249 1.448852
H -5.141303 0.837068 0.373558
H -5.157148 -1.417533 1.488298


