%chk=000095131.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095131

0 1
 S    5.014500     -0.4381000     -0.2148000    
 N  -0.6758000       1.403000     -6.9499999E-02
 N   -1.834400     -0.6332000      2.4499999E-02
 N   -3.019000       1.453500      1.3900000E-02
 N   -4.232300     -0.6145000      0.1099000    
 N   -3.046600      -2.638100      0.1182000    
 C   0.6662000      0.9710000     -0.1075000    
 C    1.671400       1.768500      0.4392000    
 C   0.9875000     -0.2557000     -0.6886000    
 C    3.319700      0.1126000     -0.1762000    
 C    2.998200       1.339300      0.4048000    
 C    2.314300     -0.6851000     -0.7229000    
 C   -1.899900      0.7091000     -7.1000000E-03
 C   -3.037500      -1.226600      8.2800001E-02
 C   -4.145500      0.7250000      7.2800003E-02
 C    4.919300      -1.990800      0.7204000    
 H    1.433700       2.725700      0.8964000    
 H   0.2449000     -0.8872000      -1.164600    
 H  -0.7895000       2.405800      4.4399999E-02
 H    3.768000       1.973900      0.8372000    
 H    2.543600      -1.637300      -1.194700    
 H   -5.078900       1.273600      9.2100002E-02
 H    4.320100      -2.730600      0.1836000    
 H    4.482000      -1.814400       1.706900    
 H    5.927900      -2.391400      0.8519000    
 H   -2.170200      -3.141100      9.8499998E-02
 H   -3.929000      -3.128700      0.1614000    


%chk=000095131-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095131

0 1
S 5.048779 -0.745514 -0.721870
N -0.660613 1.158814 0.288147
N -2.066809 -0.719437 -0.206147
N -2.942666 1.441545 0.529908
N -4.481806 -0.383220 0.062318
N -3.600290 -2.436902 -0.641792
C 0.639443 0.650809 0.045352
C 1.727763 1.543787 0.258333
C 0.900939 -0.674676 -0.395524
C 3.315349 -0.201502 -0.392797
C 3.052386 1.120446 0.039448
C 2.233279 -1.085088 -0.611145
C -1.908599 0.577807 0.189678
C -3.373740 -1.146365 -0.251981
C -4.180354 0.891449 0.441326
C 5.490854 -1.434418 0.987506
H 1.534912 2.571498 0.591528
H 0.062186 -1.351295 -0.563379
H -0.725385 2.133440 0.597383
H 3.884147 1.814937 0.195459
H 2.435597 -2.103047 -0.961089
H -5.025630 1.536387 0.700242
H 4.811240 -2.260436 1.246453
H 5.430896 -0.635919 1.742621
H 6.525228 -1.806135 0.912578
H -2.815129 -3.035469 -0.885167
H -4.559277 -2.773297 -0.684390


