%chk=000009727.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000009727

0 1
 O    4.008900     -2.9300001E-02  0.6469000    
 N   -3.759300      9.8999999E-03 -0.1766000    
 C   -1.405800      3.7900001E-02 -0.9365000    
 C   -2.366900      1.7600000E-02  0.2592000    
 C   2.5100000E-02  1.9900000E-02 -0.5179000    
 C   0.7018000       1.219200     -0.2959000    
 C   0.6870000      -1.196200     -0.3484000    
 C    2.040500       1.202500      9.5500000E-02
 C    2.025800      -1.213000      4.3099999E-02
 C    2.702600     -1.3600000E-02  0.2651000    
 C   -4.659600     -5.4900002E-02  0.9656000    
 H   -1.598200      0.9255000      -1.554300    
 H   -1.605000     -0.8213000      -1.591300    
 H   -2.180400      0.8980000      0.8872000    
 H   -2.161600     -0.8695000      0.8724000    
 H   0.1967000       2.173200     -0.4227000    
 H   0.1703000      -2.137500     -0.5163000    
 H   -3.923400     -0.7944000     -0.7816000    
 H    2.556300       2.143700      0.2657000    
 H    2.536000      -2.163400      0.1740000    
 H   -4.508600     -0.9708000       1.546100    
 H   -5.695700     -4.7899999E-02  0.6133000    
 H   -4.530400      0.8114000       1.622500    
 H    4.316600      0.8870000      0.7552000    


%chk=000009727-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000009727

0 1
O 4.106395 -0.049113 0.669068
N -3.788943 -0.022812 -0.135718
C -1.436786 0.005594 -0.950090
C -2.374282 -0.063594 0.282768
C 0.032268 0.011034 -0.558733
C 0.714765 1.227946 -0.309590
C 0.752021 -1.201278 -0.386286
C 2.066596 1.243579 0.100021
C 2.101129 -1.207766 0.021213
C 2.757516 0.019751 0.266308
C -4.761118 -0.017734 0.972765
H -1.700085 0.915118 -1.520743
H -1.652031 -0.862156 -1.606559
H -2.181657 0.811124 0.934953
H -2.117298 -0.971476 0.886706
H 0.184812 2.179154 -0.441704
H 0.249461 -2.156853 -0.580919
H -3.997628 -0.753097 -0.829979
H 2.576122 2.199160 0.282468
H 2.658190 -2.140577 0.149753
H -4.673584 -0.886969 1.670899
H -5.788572 -0.004659 0.567410
H -4.628849 0.901758 1.573042
H 4.474261 0.857866 0.813245


