%chk=000019868.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019868

0 1
 O   -2.553300       2.245700     -2.5300000E-02
 N  -0.4049000      -1.540300      6.5300003E-02
 N  -0.4041000       1.534300     -0.1485000    
 C   -1.729000      -1.123200     -0.3372000    
 C   -2.201000     -1.7000001E-02  0.5876000    
 C   0.7110000     -0.7227000      6.6399999E-02
 C   -2.668000      -2.328000     -0.2571000    
 C   0.7197000      0.6750000     -8.3800003E-02
 C   -1.736500       1.326500      9.7700000E-02
 C    1.961000      -1.378900      0.1766000    
 C    1.958200       1.349600     -0.1745000    
 C    3.174300     -0.6958000      0.1096000    
 C    3.172600      0.6748000     -7.6800004E-02
 H   -1.705700     -0.7858000      -1.381400    
 H   -1.859700     -0.1543000       1.620600    
 H   -3.297800      1.5500000E-02  0.6093000    
 H  -0.2586000      -2.525200      0.2620000    
 H   -2.314500      -3.140000     -0.9024000    
 H   -2.728700      -2.720000      0.7645000    
 H   -3.678700      -2.057900     -0.5805000    
 H  -0.1829000       2.499400     -0.3850000    
 H    1.993400      -2.461300      0.2995000    
 H    1.987100       2.430800     -0.3047000    
 H    4.111200      -1.237900      0.1914000    
 H    4.108100       1.221700     -0.1395000    


%chk=000019868-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019868

0 1
O -2.575111 2.306191 -0.232822
N -0.404566 -1.537813 -0.267165
N -0.400859 1.539406 -0.333371
C -1.819297 -1.148302 -0.380081
C -2.151234 0.031502 0.579387
C 0.727851 -0.730206 -0.114203
C -2.688389 -2.381682 -0.057720
C 0.744657 0.705441 -0.124872
C -1.742645 1.374801 -0.001519
C 1.980561 -1.400023 0.054123
C 1.984793 1.385618 0.014403
C 3.196387 -0.710065 0.181388
C 3.206936 0.705083 0.157868
H -2.054833 -0.821186 -1.416142
H -1.657419 -0.151087 1.552426
H -3.239503 0.084537 0.743015
H -0.221439 -2.541178 -0.297448
H -2.432224 -3.233968 -0.715943
H -2.550982 -2.695915 0.993306
H -3.755034 -2.148990 -0.216168
H -0.199435 2.475591 -0.701323
H 1.979628 -2.498101 0.068894
H 1.973982 2.483349 0.012187
H 4.129150 -1.271954 0.298098
H 4.142224 1.263951 0.257481


