%chk=000123217.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123217

0 1
 S    6.195700      -1.436800      0.1461000    
 N    3.720000     -0.3311000     -0.4083000    
 C   -1.550200     -3.4600001E-02  0.2544000    
 C  -0.4516000      0.9711000     -9.6000001E-02
 C   -2.957500      0.4477000     -0.1104000    
 C   0.9337000      0.4249000      0.2598000    
 C   -4.098300     -0.5272000      0.1968000    
 C    2.035900       1.418900     -0.1181000    
 C   -5.471100     -1.4900000E-02 -0.2397000    
 C    3.424100      0.9281000      0.2768000    
 C   -6.554100      -1.054900      4.1000000E-03
 C    4.773400     -0.7912000     -0.1655000    
 H   -1.515500     -0.2517000       1.329100    
 H   -1.355100     -0.9806000     -0.2657000    
 H  -0.6290000       1.910300      0.4414000    
 H  -0.4931000       1.198200      -1.168100    
 H   -3.152900       1.391800      0.4138000    
 H   -2.977200      0.6809000      -1.182600    
 H   0.9799000      0.2163000       1.335600    
 H    1.090300     -0.5265000     -0.2618000    
 H   -4.111800     -0.7359000       1.273600    
 H   -3.891200      -1.479600     -0.3068000    
 H    2.006200       1.597900      -1.200100    
 H    1.847700       2.381100      0.3730000    
 H   -5.715700      0.9025000      0.3077000    
 H   -5.451600      0.2382000      -1.306100    
 H    4.159000       1.696800      2.9000000E-03
 H    3.466800      0.7975000       1.366700    
 H   -7.528200     -0.6682000     -0.3112000    
 H   -6.353500      -1.970900     -0.5607000    
 H   -6.618100      -1.312400       1.066100    


%chk=000123217-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000123217

0 1
S 4.929963 -2.539671 -0.955922
N 3.980663 -0.048065 0.025466
C -1.514685 0.009947 0.279188
C -0.404012 1.015467 -0.100752
C -2.917571 0.438585 -0.206914
C 0.995398 0.587926 0.399859
C -4.027998 -0.573657 0.153826
C 2.103042 1.581899 -0.009477
C -5.430706 -0.141643 -0.331993
C 3.509860 1.204865 0.526025
C -6.532159 -1.163722 0.025383
C 4.382243 -1.102662 -0.394075
H -1.532228 -0.118494 1.381640
H -1.267798 -0.985109 -0.145652
H -0.654809 2.014021 0.314090
H -0.378508 1.131985 -1.204109
H -3.169184 1.428815 0.227922
H -2.896019 0.579988 -1.308005
H 0.975638 0.491999 1.505458
H 1.234423 -0.417271 0.000218
H -4.051674 -0.718003 1.254323
H -3.779717 -1.563274 -0.283572
H 2.147091 1.666741 -1.112510
H 1.867966 2.590922 0.384526
H -5.681559 0.843984 0.110166
H -5.405404 0.006882 -1.430777
H 4.237188 1.994991 0.250891
H 3.480493 1.158972 1.633977
H -7.523303 -0.837242 -0.339962
H -6.315164 -2.151585 -0.423094
H -6.604469 -1.301890 1.120653


