%chk=000150399.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150399

0 1
 S   -3.319700     -0.6922000      -1.782300    
 O   -1.380400       1.376500       2.559300    
 O    2.716000      -2.657300      0.9323000    
 O   0.6665000      -1.973500      0.5444000    
 N   -1.954500      0.2886000      0.1544000    
 N  -0.5559000     -0.2525000      -1.501000    
 N  -0.3805000       1.210900       1.897200    
 N    1.905700      -1.790900      0.5298000    
 C   0.1308000      0.2832000     -0.4272000    
 C  -0.7181000      0.6266000      0.6124000    
 C   -1.795200     -0.2244000      -1.096300    
 C    1.554600      0.4492000     -0.4251000    
 C   -3.247100      0.3367000      0.6200000    
 C   -4.119200     -0.1484000     -0.2839000    
 C    2.411700     -0.5537000      3.8199998E-02
 C    2.091400       1.649100     -0.9011000    
 C   -5.594700     -0.2556000     -0.1333000    
 C    3.792700     -0.3582000      2.5699999E-02
 C    3.472600       1.844600     -0.9134000    
 C    4.323200      0.8410000     -0.4501000    
 H   -3.498400      0.7221000       1.595900    
 H    1.444700       2.443500      -1.267200    
 H   -5.925000      0.1199000      0.8409000    
 H   -5.917000      -1.298600     -0.2152000    
 H   -6.105700      0.3279000     -0.9060000    
 H    4.490800      -1.113700      0.3772000    
 H    3.885700       2.778200      -1.284000    
 H    5.398400      0.9938000     -0.4601000    


%chk=000150399-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150399

0 1
S -3.237126 -1.543382 -1.101556
O -1.720389 2.744962 1.720043
O 2.622281 -2.996570 -0.799809
O 1.289581 -2.351050 0.937023
N -2.065571 0.434049 0.171738
N -0.435310 -0.842301 -0.820049
N -0.626614 2.181099 1.264679
N 2.098908 -2.102232 -0.032306
C 0.166026 0.205702 -0.133796
C -0.822822 1.044659 0.496542
C -1.760925 -0.676147 -0.609717
C 1.622005 0.395531 -0.142471
C -3.431379 0.652938 0.418193
C -4.236718 -0.293149 -0.172811
C 2.535764 -0.692464 -0.230628
C 2.171857 1.706479 -0.167656
C -5.729792 -0.410973 -0.141453
C 3.919519 -0.499210 -0.406348
C 3.559824 1.913981 -0.302438
C 4.435998 0.813072 -0.442842
H -3.733151 1.502917 1.026086
H 1.492370 2.559480 -0.090876
H -6.156177 0.408407 0.461929
H -6.055090 -1.367218 0.307471
H -6.167080 -0.349505 -1.154752
H 4.572038 -1.372645 -0.490704
H 3.953644 2.935169 -0.314357
H 5.511730 0.971202 -0.567633


