%chk=000095895.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095895

0 1
 O   0.1838000       1.729200       1.431100    
 O   0.1534000       2.327800     -0.7456000    
 N  -3.7799999E-02 -0.2003000      -1.658000    
 C  -2.0800000E-02 -5.1199999E-02 -0.1962000    
 C   -1.299600     -0.6841000      0.4195000    
 C    1.227500     -0.8005000      0.3513000    
 C   -2.673300     -0.2173000     -9.2000000E-02
 C    2.576600     -0.3152000     -0.2043000    
 C   0.1058000       1.446100      0.1051000    
 C   -3.866300     -0.9901000      0.4659000    
 C    3.740400      -1.071200      0.4401000    
 C   -5.167600     -0.5489000     -0.1886000    
 C    5.077900     -0.6242000     -0.1284000    
 H   -1.281800     -0.5334000       1.507400    
 H   -1.250700      -1.772000      0.2693000    
 H    1.130900      -1.873800      0.1363000    
 H    1.249300     -0.7099000       1.445800    
 H   -2.793800      0.8489000      0.1353000    
 H   -2.698700     -0.3084000      -1.183900    
 H    2.700700      0.7578000     -1.9800000E-02
 H    2.620800     -0.4691000      -1.287900    
 H   0.7833000      0.2383000      -2.071800    
 H  -0.8378000      0.2930000      -2.051500    
 H   -3.726800      -2.063700      0.2947000    
 H   -3.930600     -0.8394000       1.549400    
 H    3.736600     -0.9069000       1.523900    
 H    3.622700      -2.148500      0.2742000    
 H   -5.144800     -0.7265000      -1.268600    
 H   -6.010000      -1.108700      0.2294000    
 H   -5.349800      0.5170000     -1.8700000E-02
 H    5.127300     -0.8074000      -1.206500    
 H    5.241200      0.4440000      4.6900000E-02
 H    5.895100      -1.175300      0.3474000    
 H   0.2736000       2.692200       1.594500    


%chk=000095895-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095895

0 1
O 0.000769 1.533007 1.460921
O 0.034600 2.315055 -0.718494
N -0.019824 -0.331323 -1.786406
C -0.017146 -0.161123 -0.324448
C -1.297026 -0.818985 0.280522
C 1.243145 -0.856620 0.280179
C -2.642159 -0.230875 -0.201872
C 2.604179 -0.311070 -0.206726
C 0.008154 1.342298 0.067957
C -3.849667 -0.903419 0.492590
C 3.792930 -1.016449 0.487259
C -5.206704 -0.350871 0.007412
C 5.164230 -0.504351 -0.002445
H -1.240735 -0.736579 1.382194
H -1.251784 -1.893272 0.016998
H 1.164517 -1.929499 0.018902
H 1.191039 -0.770361 1.381941
H -2.677244 0.860933 -0.006256
H -2.750679 -0.363873 -1.298044
H 2.672088 0.780010 -0.015557
H 2.705635 -0.451099 -1.302622
H 0.821824 0.047664 -2.234851
H -0.858371 0.057233 -2.232388
H -3.807257 -1.997209 0.313820
H -3.760532 -0.763544 1.589209
H 3.710407 -0.871070 1.583689
H 3.718936 -2.109048 0.311634
H -5.333436 -0.509294 -1.080237
H -6.051745 -0.844779 0.521182
H -5.283759 0.736249 0.198288
H 5.283606 -0.669097 -1.090003
H 5.272628 0.580620 0.185346
H 5.996125 -1.020878 0.510520
H 0.019958 2.509922 1.655484


