%chk=000149370.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149370

0 1
 S   0.5245000     -0.9167000     -5.0400000E-02
 S    3.716200      0.9105000      0.7489000    
 N   -2.578900     -0.4134000      0.3066000    
 N    5.146300     -0.3712000     -0.9815000    
 N   -4.156500       1.331700     -0.2087000    
 N   -4.676000     -0.9775000     -0.5887000    
 N    5.918100       1.799300     -0.4491000    
 N   -2.471100       2.997000      0.5973000    
 C   -2.084000      -1.767400      0.4090000    
 C  -0.6764000      -1.801700      0.9911000    
 C    2.012400      -1.272500      0.9110000    
 C    3.242600     -0.6602000      0.3000000    
 C   -3.833200     -7.8900002E-02 -0.1798000    
 C    4.098000      -1.192700     -0.6150000    
 C    5.046300      0.7634000     -0.3252000    
 C   -5.979000     -0.5706000      -1.090100    
 C   -3.249200       2.221000      0.2247000    
 H   -2.747900      -2.346300       1.061500    
 H   -2.096200      -2.246600     -0.5774000    
 H  -0.6730000      -1.346100       1.987400    
 H  -0.3552000      -2.843900       1.089400    
 H    2.145600      -2.359200      0.9629000    
 H    1.875000     -0.9120000       1.936700    
 H   -1.941400      0.3163000      0.6096000    
 H    4.020300      -2.175600      -1.060100    
 H   -5.063400       1.622000     -0.5573000    
 H    6.717100       1.753700      -1.072900    
 H    5.804000       2.659600      7.6600000E-02
 H   -6.565000     -5.8300000E-02 -0.3201000    
 H   -6.540200      -1.463300      -1.383800    
 H   -5.889200      6.2600002E-02  -1.978700    


%chk=000149370-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149370

0 1
S 0.581071 -3.086719 -0.168342
S 1.689563 0.222927 0.894027
N -1.699790 -0.658880 -0.016419
N 3.951323 0.529928 -0.533449
N -2.368061 1.488887 -0.831133
N -3.987115 -0.283060 -0.430633
N 2.734058 2.582827 -0.163646
N -0.215405 2.678791 -0.191446
C -1.973882 -2.010060 0.497660
C -0.729720 -2.634876 1.142637
C 2.206849 -2.608696 0.770317
C 2.690971 -1.240481 0.454896
C -2.751235 0.134942 -0.425362
C 3.807649 -0.836242 -0.258722
C 2.933341 1.234377 -0.049593
C -5.111654 0.616501 -0.722587
C -1.237588 2.130935 -0.492600
H -2.782733 -1.931606 1.248554
H -2.367709 -2.663163 -0.307805
H -0.267837 -1.932330 1.857980
H -1.012112 -3.559928 1.670939
H 2.945348 -3.363441 0.453509
H 1.981829 -2.770751 1.838460
H -0.736876 -0.449481 -0.301859
H 4.564509 -1.523438 -0.642648
H -3.057034 1.987882 -1.397417
H 3.447498 3.121575 -0.652287
H 1.780337 2.953713 -0.062254
H -4.979479 1.663313 -0.361930
H -6.016640 0.217694 -0.233513
H -5.328873 0.651860 -1.811431


