%chk=000171205.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171205

0 1
 O   -4.324800      -1.228500     -0.4386000    
 O   -2.963500      -2.161100       1.021300    
 O   -2.010500       2.933000      0.2391000    
 O    4.725500      -1.610400     -0.7978000    
 N  -0.6085000       1.259800      0.4116000    
 N   -3.227600      -1.370500      0.1098000    
 N  -0.8292000       2.589700      0.1277000    
 N    4.596800     -0.6939000      2.7400000E-02
 C   -2.106900     -0.5228000     -0.3891000    
 C   -1.623700      0.3100000      0.8057000    
 C   -2.691400      0.3324000      -1.512700    
 C   -1.039300      -1.484800     -0.9108000    
 C   0.7417000      0.7531000      0.3119000    
 C    1.119800     -0.2896000       1.128900    
 C    1.600700       1.331700     -0.5964000    
 C    2.422700     -0.7786000       1.032800    
 C    2.903600      0.8427000     -0.6927000    
 C    3.314500     -0.2123000      0.1220000    
 H   -1.348300     -0.3101000       1.663100    
 H   -2.490700      0.8552000       1.210200    
 H   -3.475700       1.013900      -1.161100    
 H   -3.108000     -0.2750000      -2.326900    
 H   -1.914000      0.9488000      -1.978700    
 H  -0.5842000      -2.083500     -0.1147000    
 H   -1.476300      -2.200000      -1.620600    
 H  -0.2493000     -0.9665000      -1.461600    
 H   0.4967000     -0.7449000       1.887000    
 H    1.305800       2.142000      -1.255900    
 H    2.729500      -1.595600       1.682200    
 H    3.584500       1.293800      -1.411200    


%chk=000171205-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171205

0 1
O -4.648402 -1.258285 -0.122624
O -3.095394 -2.007395 1.362645
O -1.930907 2.899721 0.080597
O 5.332711 -1.500568 0.516802
N -0.511966 1.131582 0.255503
N -3.452630 -1.326809 0.327497
N -0.721046 2.523238 -0.021933
N 4.970954 -0.414309 -0.070555
C -2.303918 -0.546306 -0.424743
C -1.633969 0.293808 0.718426
C -2.924835 0.328582 -1.520505
C -1.378192 -1.636515 -1.008132
C 0.851088 0.709240 0.187051
C 1.277492 -0.484395 0.844079
C 1.794333 1.498366 -0.534844
C 2.619163 -0.882080 0.783532
C 3.136021 1.094058 -0.589870
C 3.555986 -0.093832 0.063444
H -1.307333 -0.376325 1.526906
H -2.389437 0.991304 1.126375
H -3.620500 1.075164 -1.107041
H -3.468152 -0.291512 -2.251271
H -2.118038 0.863874 -2.051294
H -1.003767 -2.312676 -0.222288
H -1.923033 -2.236117 -1.758009
H -0.519183 -1.163875 -1.513092
H 0.567488 -1.094633 1.407859
H 1.464234 2.409132 -1.036975
H 2.968934 -1.791200 1.284767
H 3.882197 1.676761 -1.140408


