%chk=000030922.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030922

0 1
 O   6.0100000E-02   1.306300     -0.3377000    
 O  -0.4950000      0.3520000      -2.617400    
 N   -4.979500      0.2366000      0.3768000    
 C  -7.1099997E-02 -0.1350000     -0.3215000    
 C    1.401300       1.708400      5.4099999E-02
 C    1.237800     -0.6394000      0.1780000    
 C    2.096700      0.4307000      0.3953000    
 C   -1.251600     -0.5072000      0.5639000    
 C  -0.3248000     -0.5039000      -1.750500    
 C   -2.560000      6.8800002E-02  2.2500001E-02
 C    2.040100       2.423300      -1.134600    
 C    1.282900       2.645000       1.254700    
 C    1.643700      -1.943200      0.4185000    
 C    3.387300      0.2272000      0.8603000    
 C   -3.744700     -0.3386000      0.8970000    
 C    2.940500      -2.160400      0.8874000    
 C  -0.3589000      -1.973000      -2.074300    
 C    3.807700      -1.080800       1.107200    
 C   -6.112500     -0.1170000       1.220300    
 H   -1.345100      -1.594600      0.6703000    
 H   -1.092200     -0.1086000       1.575200    
 H   -2.499200       1.163400     -2.1100000E-02
 H   -2.748000     -0.2866000     -0.9973000    
 H    1.444700       3.294700      -1.430300    
 H    2.087200       1.767800      -2.012300    
 H    3.057900       2.759200     -0.9088000    
 H   0.6788000       3.524300       1.003200    
 H    2.262500       2.986800       1.605400    
 H   0.7752000       2.150000       2.091200    
 H   0.9774000      -2.785300      0.2695000    
 H    4.060700       1.060500       1.030400    
 H   -3.819400      -1.432600      0.9257000    
 H   -3.571300      1.3700000E-02   1.921100    
 H    3.280300      -3.172800       1.087700    
 H   0.6562000      -2.358700      -2.188100    
 H  -0.9083000      -2.541100      -1.322200    
 H  -0.8826000      -2.108100      -3.026400    
 H    4.814100      -1.264900       1.472900    
 H   -5.143300     -0.1027000     -0.5706000    
 H   -5.985000      0.2665000       2.237900    
 H   -6.260400      -1.201100       1.261400    
 H   -7.023800      0.3313000      0.8125000    


%chk=000030922-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000030922

0 1
O 0.041173 1.326072 -0.235092
O 0.188378 0.236486 -2.774648
N -5.033156 0.222636 0.485902
C -0.042278 -0.145500 -0.347587
C 1.452663 1.776019 0.059454
C 1.301200 -0.636335 0.199470
C 2.160423 0.469060 0.398241
C -1.264140 -0.615384 0.481448
C -0.144971 -0.557882 -1.863155
C -2.592138 0.041832 0.047328
C 2.032677 2.473977 -1.188962
C 1.359807 2.736724 1.261601
C 1.729693 -1.944908 0.500244
C 3.468650 0.278881 0.882277
C -3.778221 -0.426139 0.911670
C 3.042793 -2.138663 0.992791
C -0.620806 -1.972277 -2.185150
C 3.909607 -1.034382 1.175850
C -6.224135 -0.166350 1.260856
H -1.342263 -1.720159 0.429274
H -1.056770 -0.359866 1.538162
H -2.496245 1.138941 0.118078
H -2.804328 -0.188910 -1.019085
H 1.449469 3.384687 -1.410889
H 1.970921 1.806879 -2.062905
H 3.086786 2.762745 -1.016997
H 0.690967 3.578245 1.011027
H 2.355909 3.145434 1.513111
H 0.954346 2.217141 2.146314
H 1.061743 -2.805054 0.374933
H 4.136808 1.133370 1.039309
H -3.839417 -1.547958 0.885002
H -3.592556 -0.149916 1.969804
H 3.389623 -3.149019 1.235942
H -0.032747 -2.728308 -1.634138
H -1.679067 -2.103515 -1.893547
H -0.520299 -2.149566 -3.267141
H 4.924707 -1.197539 1.554543
H -5.179939 0.132563 -0.528234
H -6.103910 0.160193 2.310985
H -6.428350 -1.266564 1.275825
H -7.116209 0.343208 0.855389


