%chk=000014344.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014344

0 1
 O    1.493300      0.2722000     -0.9140000    
 O    2.104100      9.3699999E-02   1.322400    
 N    3.574900     -0.5128000     -0.3660000    
 C   -1.885900      -2.399600     -0.5333000    
 C   -2.850800      -1.964700      0.5622000    
 C  -0.5821000      -1.609100     -0.4411000    
 C   -3.221600     -0.4924000      0.3944000    
 C  -0.7962000     -0.1245000     -0.2811000    
 C   -2.029000      0.3984000      0.1511000    
 C   0.2782000      0.7475000     -0.5142000    
 C   -2.172400       1.785600      0.3059000    
 C   0.1255000       2.123400     -0.3469000    
 C   -1.099900       2.642400      6.0400002E-02
 C    2.378100     -4.2100001E-02  0.1337000    
 C    4.683700     -0.9180000      0.4664000    
 H   -2.350200      -2.241800      -1.515200    
 H   -1.673400      -3.471100     -0.4469000    
 H   -2.386700      -2.123400       1.544000    
 H   -3.758200      -2.578200      0.5330000    
 H   5.9000002E-03  -1.814300      -1.343600    
 H  -6.8000001E-03  -1.967300      0.4217000    
 H   -3.758600     -0.1607000       1.291100    
 H   -3.903800     -0.3863000     -0.4585000    
 H   -3.124900       2.205900      0.6198000    
 H   0.9579000       2.796500     -0.5340000    
 H   -1.221500       3.714200      0.1870000    
 H    3.681500     -0.5794000      -1.373600    
 H    5.549800     -0.3066000      0.2019000    
 H    4.903600      -1.967000      0.2542000    
 H    4.452300     -0.7947000       1.526900    


%chk=000014344-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014344

0 1
O 1.569953 0.476225 -0.777696
O 2.065498 -0.388918 1.383979
N 3.591301 -0.472594 -0.407435
C -1.751851 -2.403498 -0.428857
C -2.808028 -1.964598 0.608233
C -0.479266 -1.539913 -0.296408
C -3.250970 -0.513350 0.324570
C -0.776382 -0.048636 -0.195926
C -2.078844 0.442822 0.107755
C 0.254265 0.904217 -0.393815
C -2.299809 1.840890 0.191208
C 0.041309 2.291464 -0.322866
C -1.255876 2.763700 -0.026689
C 2.395147 -0.163348 0.196494
C 4.678594 -1.136537 0.314738
H -2.178812 -2.300375 -1.447100
H -1.489118 -3.469516 -0.292699
H -2.370038 -2.033276 1.623930
H -3.686538 -2.636780 0.583193
H 0.204322 -1.722589 -1.148185
H 0.078362 -1.842032 0.613124
H -3.885433 -0.133982 1.148719
H -3.889835 -0.506063 -0.583874
H -3.306664 2.205848 0.429719
H 0.878920 2.973984 -0.495377
H -1.444841 3.840458 0.039657
H 3.701762 -0.209620 -1.386891
H 5.588761 -0.508952 0.336738
H 4.927238 -2.113038 -0.140930
H 4.343673 -1.306192 1.350390


