%chk=000021052.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021052

0 1
 O   0.8884000       2.406000      0.3524000    
 N   -4.513100     -0.8156000     -0.6802000    
 C  -0.6546000      0.6718000     -8.1100002E-02
 C   -2.657100     -0.2902000      0.8152000    
 C   -1.368600      0.2077000       1.008900    
 C   -3.209900     -0.3156000     -0.4653000    
 C   0.7103000       1.199800      0.1233000    
 C   -1.185400      0.6549000      -1.358300    
 C    1.869300      0.3250000      4.6900000E-02
 C   -2.473900      0.1571000      -1.552000    
 C   -3.422800     -0.7900000       1.997000    
 C    1.700400      -1.035700     -0.2099000    
 C    3.150200      0.8464000      0.2301000    
 C    2.812100      -1.874900     -0.2833000    
 C    4.261900      7.0000002E-03  0.1565000    
 C    4.092700      -1.353600     -0.1002000    
 H  -0.9290000      0.2323000       2.002700    
 H  -0.6182000       1.021600      -2.209000    
 H   -2.892500      0.1433000      -2.555100    
 H   -2.845700     -0.6992000       2.923800    
 H   -4.343100     -0.2118000       2.131200    
 H   -3.671700      -1.849200       1.873600    
 H   0.7249000      -1.488100     -0.3591000    
 H    3.311700       1.902000      0.4313000    
 H    2.681200      -2.934500     -0.4830000    
 H    5.259300      0.4125000      0.2990000    
 H   -5.069600      -1.165600      8.6900003E-02
 H   -4.896200     -0.8266000      -1.616400    
 H    4.958300      -2.007100     -0.1574000    


%chk=000021052-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021052

0 1
O 1.083024 2.026577 -1.525824
N -4.778588 -0.298682 -0.243210
C -0.646728 0.591674 -0.672698
C -2.478996 -0.514378 0.582514
C -1.116031 -0.208870 0.407816
C -3.423479 -0.009328 -0.373171
C 0.778685 0.987855 -0.847848
C -1.606004 1.103279 -1.592207
C 1.888171 0.170531 -0.232795
C -2.965003 0.801992 -1.455094
C -2.959168 -1.348658 1.755702
C 1.826230 -1.243684 -0.109882
C 3.078371 0.844206 0.152726
C 2.928222 -1.965125 0.401382
C 4.170589 0.126286 0.679530
C 4.098187 -1.282474 0.806974
H -0.402032 -0.570679 1.156149
H -1.249581 1.741691 -2.407310
H -3.691166 1.190796 -2.179751
H -2.115441 -1.648128 2.399096
H -3.675944 -0.791559 2.392938
H -3.463242 -2.279310 1.423258
H 0.933683 -1.780691 -0.447936
H 3.124992 1.929996 0.018418
H 2.877290 -3.057283 0.475633
H 5.078872 0.657773 0.984665
H -5.124835 -0.870556 0.521024
H -5.450731 0.069222 -0.910725
H 4.949952 -1.842773 1.209126


