%chk=000159701.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159701

0 1
 S  -0.7903000      -2.529400       1.935300    
 S   0.7922000      -2.529500      -1.935200    
 S  -0.9116000      -3.957500      0.4665000    
 S   0.9158000      -3.956600     -0.4657000    
 N   -2.642500     -0.7757000       1.144700    
 N    2.643000     -0.7740000      -1.144800    
 C  -0.7002000     -0.2666000      0.1995000    
 C   0.7000000     -0.2660000     -0.2004000    
 C   -1.665100      0.6929000     -0.2291000    
 C    1.664300      0.6940000      0.2285000    
 C   -2.875200      0.3464000      0.3803000    
 C    2.874900      0.3480000     -0.3802000    
 C   -1.334700      -1.156700       1.033200    
 C    1.335500      -1.155800      -1.033800    
 C   -1.638400       1.821500      -1.076300    
 C    1.636600       1.822600       1.075700    
 C   -4.055200       1.073700      0.1875000    
 C    4.054500       1.075800     -0.1866000    
 C   -2.811500       2.557300      -1.278100    
 C    2.809400       2.558800       1.278200    
 C   -4.000400       2.187500     -0.6543000    
 C    3.998900       2.189500      0.6552000    
 H   -3.338100      -1.248000       1.705300    
 H    3.339100      -1.246100      -1.705000    
 H  -0.7210000       2.124700      -1.573000    
 H   0.7188000       2.125400       1.571900    
 H   -4.982200      0.7862000      0.6724000    
 H    4.981900      0.7886000     -0.6709000    
 H   -2.792700       3.426900      -1.929700    
 H    2.789900       3.428300       1.929800    
 H   -4.900300       2.772900     -0.8246000    
 H    4.898500       2.775300      0.8260000    


%chk=000159701-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159701

0 1
S -0.733434 -2.529637 1.982010
S 0.734976 -2.529122 -1.981907
S -0.953229 -4.436322 0.560549
S 0.955902 -4.435725 -0.560510
N -2.744793 -0.837867 1.081760
N 2.745278 -0.836125 -1.081590
C -0.706465 -0.260635 0.187812
C 0.706572 -0.260179 -0.187672
C -1.688331 0.737790 -0.188482
C 1.687800 0.738868 0.188634
C -2.956006 0.342608 0.373817
C 2.955728 0.344501 -0.373667
C -1.388440 -1.206541 0.997179
C 1.389155 -1.205648 -0.997035
C -1.616246 1.916679 -0.981017
C 1.614958 1.917712 0.981168
C -4.136018 1.094352 0.172643
C 4.135257 1.097004 -0.172491
C -2.786933 2.667104 -1.181915
C 2.785163 2.668891 1.182066
C -4.032429 2.260505 -0.609180
C 4.030919 2.263092 0.609331
H -3.434078 -1.353323 1.626699
H 3.434899 -1.351156 -1.626505
H -0.664345 2.226533 -1.424866
H 0.662859 2.226964 1.425013
H -5.095313 0.785757 0.601462
H 5.094751 0.789022 -0.601303
H -2.752239 3.578575 -1.788185
H 2.749880 3.580342 1.788330
H -4.926271 2.868611 -0.787085
H 4.924371 2.871770 0.787235


