%chk=000026028.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026028

0 1
 S   -3.115400      -1.657000     -0.3132000    
 O  -4.7400001E-02   1.062500       1.679400    
 O   -2.267900       1.364000      -1.621700    
 N  -0.8022000     -0.2985000     -4.0399998E-02
 N   -3.816700       1.625100      5.4200001E-02
 C   -2.218300     -0.1795000      0.2491000    
 C    1.570400      0.1314000      0.2605000    
 C   0.1715000      0.3414000      0.7100000    
 C   -2.738500       1.007500     -0.5434000    
 C    2.512400       1.101500      0.5359000    
 C    1.886000      -1.027300     -0.4194000    
 C    3.827100      0.9044000      0.1132000    
 C    3.200700      -1.224400     -0.8421000    
 C    4.171200     -0.2586000     -0.5757000    
 C   -2.332800      -2.892500      0.7535000    
 H   -2.371100     -1.8800000E-02   1.321500    
 H  -0.5611000     -0.8037000     -0.8859000    
 H    2.259900       2.014800       1.066500    
 H    1.170400      -1.819000     -0.6153000    
 H    4.582700       1.656800      0.3197000    
 H    3.471000      -2.133500      -1.371400    
 H    5.195200     -0.4129000     -0.9033000    
 H   -1.275100      -3.007000      0.5032000    
 H   -2.826600      -3.856400      0.6042000    
 H   -2.436100      -2.610100       1.804400    
 H   -4.204700       1.309000      0.9372000    
 H   -4.263700       2.426600     -0.3785000    


%chk=000026028-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026028

0 1
S -3.162427 -1.600570 0.280352
O -0.040136 -0.007451 1.978992
O -2.314221 1.385679 -1.910620
N -0.811418 -0.043505 -0.215650
N -4.265545 1.131851 -0.663233
C -2.193328 0.078181 0.162380
C 1.614761 -0.117748 0.197903
C 0.209863 -0.055669 0.731112
C -2.928218 0.925569 -0.901327
C 2.664623 0.240726 1.082401
C 1.929245 -0.533996 -1.122888
C 4.005647 0.203863 0.649421
C 3.273239 -0.575489 -1.553168
C 4.313734 -0.201660 -0.671147
C -2.213471 -2.404773 1.696499
H -2.258039 0.517620 1.172645
H -0.617670 0.147515 -1.205600
H 2.400792 0.539567 2.102128
H 1.141531 -0.858877 -1.812505
H 4.809522 0.488400 1.336975
H 3.508650 -0.904498 -2.571076
H 5.355815 -0.232959 -1.008176
H -1.231127 -2.747893 1.342008
H -2.822354 -3.263393 2.021642
H -2.083133 -1.687825 2.519564
H -4.740487 0.647450 0.099907
H -4.804950 1.675683 -1.336340


