%chk=000097212.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097212

0 1
 S   -3.738400      -1.431900      0.4751000    
 N   -3.768500       1.632300      6.2899999E-02
 C    1.226000       1.962600     -0.2289000    
 C  -0.1192000       1.284900     -7.1500003E-02
 C   4.6200000E-02 -0.1067000      0.1087000    
 C    2.177400      0.7898000     -0.1167000    
 C    1.460500     -0.4117000      8.0799997E-02
 C   -1.374200       1.867800     -8.8500001E-02
 C   -1.054800     -0.9303000      0.2745000    
 C    3.559400      0.8041000     -0.1858000    
 C    2.129900      -1.617000      0.2117000    
 C   -2.483800       1.037300      7.8800000E-02
 C   -2.325800     -0.3477000      0.2584000    
 C    4.233900     -0.4111000     -5.3900000E-02
 C    3.526400      -1.609500      0.1429000    
 C   -3.495000      -2.513000     -0.9487000    
 H    1.396200       2.678500      0.5805000    
 H    1.308600       2.436100      -1.211400    
 H   -1.482500       2.938700     -0.2278000    
 H  -0.9177000      -1.996900      0.4249000    
 H    4.106700       1.727800     -0.3373000    
 H    1.597900      -2.550100      0.3640000    
 H    5.319300     -0.4326000     -0.1036000    
 H    4.074100      -2.543100      0.2428000    
 H   -3.865300       2.630100     -6.9700003E-02
 H   -4.589500       1.053200      0.1784000    
 H   -2.610100      -3.142200     -0.8229000    
 H   -3.398100      -1.928100      -1.867700    
 H   -4.364400      -3.168700      -1.050100    


%chk=000097212-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097212

0 1
S -3.639157 -1.709603 0.658174
N -3.787336 1.278873 0.002273
C 1.252402 1.912934 -0.357996
C -0.067909 1.180178 -0.140682
C 0.185317 -0.193297 0.165061
C 2.292239 0.816222 -0.142356
C 1.640740 -0.419225 0.165910
C -1.373189 1.681649 -0.198105
C -0.897847 -1.066306 0.402418
C 3.693505 0.889528 -0.207668
C 2.402118 -1.584774 0.409728
C -2.478503 0.808590 0.047284
C -2.217595 -0.574024 0.336399
C 4.457112 -0.281382 0.037054
C 3.813249 -1.506102 0.343006
C -4.095410 -2.141431 -1.134926
H 1.381332 2.750031 0.356110
H 1.318167 2.350380 -1.373737
H -1.563035 2.738705 -0.422431
H -0.737997 -2.123823 0.637988
H 4.196347 1.835161 -0.442993
H 1.913608 -2.536465 0.648517
H 5.551140 -0.239551 -0.009869
H 4.416624 -2.401770 0.530467
H -3.980165 2.265207 -0.144780
H -4.533310 0.658076 0.320063
H -3.270079 -2.703373 -1.596292
H -4.294186 -1.217699 -1.699705
H -5.002982 -2.764107 -1.089012


