%chk=000045781.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045781

1 1
 O   -1.035700       2.189400      1.2100000E-02
 O    3.073200      -1.487000     -2.4999999E-03
 N   -1.680000     -0.5686000     -4.8000002E-03
 C  -0.2329000     -6.9899999E-02 -3.9999999E-04
 C   -1.673000      -2.094700     -1.1800000E-02
 C   -2.383800     -2.3100000E-02  -1.244100    
 C   -2.455300     -0.1022000       1.225700    
 C  -3.0099999E-02   1.269600      7.1000000E-03
 C   0.7319000      -1.023000     -3.5000001E-03
 C    2.055600     -0.5832000      1.4000000E-03
 C    1.293600       1.709500      1.1800000E-02
 C    2.336500      0.7831000      8.8999998E-03
 H   -1.222800      -2.477200      0.9108000    
 H   -2.720000      -2.421600     -2.3200000E-02
 H   -1.214000      -2.464700     -0.9351000    
 H   -1.748300     -0.2013000      -2.117700    
 H   -3.322000     -0.5762000      -1.361800    
 H   -2.626500       1.035000      -1.135400    
 H   -2.617800      0.9765000       1.201500    
 H   -3.428400     -0.6044000       1.224900    
 H   -1.888900     -0.3881000       2.117700    
 H   0.6097000      -2.096400     -8.6000003E-03
 H    1.527100       2.770900      1.8100001E-02
 H    3.363400       1.138600      1.2500000E-02
 H  -0.6498000       3.082100      1.7400000E-02
 H    3.919800      -1.008200      1.5000000E-03


%chk=000045781-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000045781

1 1
O -1.101939 2.200385 0.021100
O 3.126881 -1.510277 0.002090
N -1.698887 -0.595892 -0.016179
C -0.262563 -0.086876 -0.001272
C -1.778630 -2.123259 -0.035379
C -2.421651 -0.083113 -1.276846
C -2.437111 -0.113777 1.247571
C -0.007883 1.314228 0.017247
C 0.812061 -0.994790 -0.005765
C 2.145872 -0.523005 0.008187
C 1.327567 1.770212 0.031117
C 2.406722 0.867105 0.026829
H -1.303889 -2.532086 0.867963
H -2.843435 -2.400073 -0.047203
H -1.289305 -2.510000 -0.940672
H -1.882263 -0.458442 -2.159108
H -3.453334 -0.467795 -1.264607
H -2.419307 1.013976 -1.262065
H -2.431519 0.983309 1.261222
H -3.469564 -0.494846 1.211678
H -1.910637 -0.513376 2.126945
H 0.679081 -2.077262 -0.019880
H 1.528283 2.848031 0.045485
H 3.433544 1.248292 0.037813
H -0.811362 3.145619 0.033954
H 4.044767 -1.141387 0.012277


