%chk=000091770.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091770

0 1
 O   -3.133900       2.483900      0.2328000    
 O   0.7485000      -2.542800     -0.8906000    
 O   0.8412000      -2.504300       1.380200    
 N   -1.114500     -0.4368000      0.3332000    
 N  -0.9191000       1.790400      0.1127000    
 N    1.745700       1.696500     -0.1000000    
 C   -2.485700      0.1331000      0.3936000    
 C   -3.308900     -0.4203000     -0.7621000    
 C   -2.267200       1.624700      0.2388000    
 C   -3.103000     -0.1903000       1.747900    
 C   -2.616200     -0.1499000      -2.097500    
 C   -3.555300      -1.918000     -0.5824000    
 C  -0.3173000      0.5761000      0.1739000    
 C    1.121900      0.5030000      6.2700003E-02
 C    1.799300     -0.7105000      0.1197000    
 C    3.184900     -0.6977000      4.1999999E-03
 C    3.851800      0.5109000     -0.1634000    
 C    3.093100       1.669300     -0.2086000    
 C    1.101700      -1.975500      0.2950000    
 C    5.333100      0.5584000     -0.2899000    
 H   -4.285100      8.2000002E-02 -0.7895000    
 H   -4.160000      9.5799997E-02   1.783700    
 H   -3.015700      -1.251600       2.003000    
 H   -2.595300      0.3625000       2.547900    
 H   -1.653900     -0.6655000      -2.183400    
 H   -3.242700     -0.5126000      -2.921000    
 H   -2.456900      0.9178000      -2.275500    
 H   -2.623000      -2.480100     -0.4648000    
 H   -4.072200      -2.324800      -1.459200    
 H   -4.197300      -2.125600      0.2791000    
 H  -0.4523000       2.682100     -7.4999998E-03
 H    3.745000      -1.628900      4.3200001E-02
 H    3.555200       2.643000     -0.3391000    
 H    5.626700      0.4143000      -1.334400    
 H    5.730200       1.519200      5.4900002E-02
 H    5.804300     -0.2208000      0.3188000    
 H   0.2749000      -3.392200     -0.7619000    


%chk=000091770-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091770

0 1
O -3.188029 2.567324 0.027022
O 0.562190 -2.276160 -1.363469
O 1.305923 -2.987341 0.724333
N -1.112325 -0.434294 0.339417
N -0.927432 1.823701 -0.066987
N 1.814559 1.695089 -0.059377
C -2.499612 0.147427 0.396919
C -3.424648 -0.509223 -0.688186
C -2.314362 1.669548 0.097056
C -3.057511 -0.009064 1.833291
C -2.846831 -0.324425 -2.112474
C -3.685823 -2.003710 -0.393399
C -0.299155 0.568478 0.072363
C 1.169723 0.486824 -0.041788
C 1.877355 -0.747120 -0.071491
C 3.287534 -0.705168 -0.024187
C 3.972824 0.535599 -0.013249
C 3.173512 1.706819 -0.061333
C 1.206694 -2.089181 -0.138830
C 5.483119 0.613555 0.038155
H -4.382532 0.047441 -0.625918
H -4.081089 0.401993 1.881666
H -3.069247 -1.071190 2.124459
H -2.428396 0.535557 2.559069
H -1.871061 -0.834503 -2.211435
H -3.538202 -0.753794 -2.859986
H -2.710020 0.743130 -2.363785
H -2.730124 -2.550284 -0.297868
H -4.265264 -2.455051 -1.219651
H -4.261550 -2.154755 0.536409
H -0.408542 2.688812 -0.229253
H 3.850222 -1.645169 -0.008032
H 3.644111 2.696464 -0.094641
H 5.943087 0.051331 -0.795055
H 5.834229 1.657594 -0.021339
H 5.872160 0.179363 0.977919
H 0.086513 -3.150816 -1.351844


