%chk=000051109.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051109

0 1
 O   -3.441500     -0.8277000      0.2680000    
 O   -3.608700       1.190600     -0.8176000    
 O    1.357500       3.074700       1.218400    
 N   0.5212000       1.480500      0.1230000    
 N   -1.688300      0.5743000      0.3241000    
 N    1.244200       2.581700      8.9699998E-02
 C   0.8972000      0.5082000     -0.9179000    
 C    2.037800     -0.3708000     -0.4786000    
 C  -0.9163000       1.774800      5.5300001E-02
 C    1.768000      -1.563600      0.1778000    
 C    3.343300      2.4200000E-02 -0.7358000    
 C    2.825000      -2.377800      0.5850000    
 C    4.400200     -0.7899000     -0.3286000    
 C    4.141000      -1.990800      0.3318000    
 C   -2.973300      0.3886000     -0.1407000    
 C   -4.773900      -1.153300     -0.1435000    
 C   -5.133500      -2.523700      0.3895000    
 H   6.9799997E-02 -0.1626000      -1.186400    
 H    1.144700       1.007900      -1.867000    
 H   -1.210000       2.188100     -0.9187000    
 H   -1.215500       2.493800      0.8288000    
 H   0.7471000      -1.873900      0.3822000    
 H    3.558000      0.9556000      -1.252100    
 H   -1.276900     -0.1422000      0.9141000    
 H    2.623400      -3.312600       1.099800    
 H    5.424900     -0.4892000     -0.5263000    
 H    4.963900      -2.624600      0.6488000    
 H   -5.471000     -0.4070000      0.2535000    
 H   -4.827400      -1.155900      -1.237800    
 H   -4.433700      -3.278400      1.5799999E-02
 H   -5.066700      -2.541900       1.482400    
 H   -6.147900      -2.804900      9.3000002E-02


%chk=000051109-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051109

0 1
O -2.655125 -0.687392 0.900618
O -2.110664 -0.249705 -1.352112
O 0.409581 3.393541 1.515054
N 0.548121 2.216745 -0.391824
N -1.598944 1.255583 0.377823
N 1.200801 2.861896 0.643699
C 1.423871 1.453785 -1.317166
C 1.627599 -0.005926 -0.914372
C -0.937008 2.227471 -0.477223
C 1.021702 -1.055771 -1.645602
C 2.448880 -0.318851 0.199640
C 1.240982 -2.402903 -1.275283
C 2.666409 -1.663104 0.570990
C 2.064909 -2.709640 -0.168757
C -2.113703 0.080140 -0.135814
C -3.226155 -2.002637 0.486878
C -3.782901 -2.651484 1.749831
H 0.989545 1.522443 -2.329573
H 2.391223 1.986983 -1.314891
H -1.213624 2.010692 -1.520331
H -1.255171 3.243783 -0.189541
H 0.362103 -0.822796 -2.488871
H 2.911631 0.493145 0.774101
H -1.638814 1.420818 1.384511
H 0.768368 -3.207432 -1.849538
H 3.304518 -1.895901 1.430828
H 2.237651 -3.753572 0.116608
H -4.005608 -1.823253 -0.275543
H -2.419389 -2.600648 0.025169
H -2.987356 -2.800938 2.499574
H -4.573039 -2.025898 2.199019
H -4.217793 -3.636972 1.502097


