%chk=000023242.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023242

0 1
 O   -2.949600      -1.118800     -6.1500002E-02
 O   -4.138800      0.8564000      0.2452000    
 N   0.4348000       1.043700      0.4562000    
 N  -0.6839000      0.2957000      0.5240000    
 N   -1.377100       3.279000     -0.7109000    
 C    4.181600     -0.7608000     -0.1326000    
 C    1.687300      0.4404000      0.2596000    
 C    4.087900      0.6243000      1.3000000E-03
 C    3.030900      -1.546800     -7.1000002E-02
 C    2.843700       1.223700      0.1971000    
 C    1.786500     -0.9476000      0.1247000    
 C    5.511900      -1.402000     -0.3412000    
 C   -4.155500      -1.887300     -8.8299997E-02
 C   -3.805800      -3.346900     -0.2856000    
 C   -1.777800      0.8488000      0.1147000    
 C   -3.122400      0.2051000      0.1095000    
 C   -1.553600       2.193200     -0.3413000    
 H    4.977400       1.247300     -4.3099999E-02
 H    3.091500      -2.627200     -0.1723000    
 H    2.785300       2.304500      0.2998000    
 H   0.9118000      -1.591200      0.1673000    
 H    6.193900     -0.7327000     -0.8766000    
 H    5.959700      -1.660400      0.6235000    
 H    5.421100      -2.313600     -0.9417000    
 H   0.4334000       2.035700      0.6671000    
 H   -4.691600      -1.759700      0.8588000    
 H   -4.790000      -1.543600     -0.9132000    
 H   -4.707400      -3.965200     -0.3109000    
 H   -3.253900      -3.487900      -1.220900    
 H   -3.157000      -3.700300      0.5226000    


%chk=000023242-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023242

0 1
O -2.951648 -1.115671 -0.049315
O -4.263223 0.815729 0.107399
N 0.457932 1.061172 0.060210
N -0.684006 0.362375 0.026224
N -1.840837 3.636940 0.269562
C 4.282455 -0.823008 -0.110489
C 1.719821 0.409019 0.002333
C 4.155301 0.586785 -0.014104
C 3.090733 -1.596495 -0.155252
C 2.890097 1.205487 0.043858
C 1.816743 -1.000456 -0.098865
C 5.647593 -1.485760 -0.138877
C -4.210878 -1.925848 -0.084699
C -3.784059 -3.384779 -0.199657
C -1.858960 1.010393 0.085429
C -3.137095 0.257197 0.051312
C -1.928512 2.444255 0.187093
H 5.056769 1.209737 0.015128
H 3.163717 -2.687548 -0.236435
H 2.815276 2.297918 0.116024
H 0.902359 -1.598315 -0.135268
H 6.411090 -0.824532 -0.584718
H 5.988663 -1.737695 0.884373
H 5.630178 -2.426007 -0.717473
H 0.447777 2.094194 0.130181
H -4.781536 -1.719664 0.838891
H -4.816196 -1.589177 -0.945659
H -4.678449 -4.033434 -0.231298
H -3.199628 -3.552767 -1.120258
H -3.167179 -3.684245 0.664651


