%chk=000043134.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043134

0 1
 S    5.610900     -0.4681000     -0.2235000    
 O  -0.5504000       2.044100      0.3264000    
 O    5.730200      -1.732000     -0.9366000    
 O    6.331100      0.7034000     -0.7038000    
 N   -5.046900     -0.3500000      0.3243000    
 C   -5.425200      0.5499000     -0.7650000    
 C   -6.060700      -1.404000      0.3156000    
 C   -6.935900      0.6512000     -0.6149000    
 C   -7.353200     -0.6312000      9.8399997E-02
 C   -3.698300     -0.8747000      0.1687000    
 C   -2.668500      0.2487000      0.2457000    
 C   -1.228200     -0.2616000      0.1332000    
 C  -0.2124000      0.8698000      0.1959000    
 C    1.238800      0.5365000      9.1100000E-02
 C    1.602800     -0.7819000     -5.8100000E-02
 C    2.155900       1.560700      0.1488000    
 C    3.913800     -7.7900000E-02 -0.1003000    
 C    2.959000      -1.093500     -0.1551000    
 C    3.512200       1.249300      5.1700000E-02
 C    6.125100     -0.7388000       1.457600    
 H   -5.177900      0.1300000      -1.748500    
 H   -4.970400       1.541400     -0.6796000    
 H   -6.080600      -1.966500       1.254300    
 H   -5.907400      -2.109000     -0.5117000    
 H   -7.429600      0.7531000      -1.586700    
 H   -7.210700       1.520200     -5.5000000E-03
 H   -7.825600     -0.3853000       1.056800    
 H   -8.072000      -1.208400     -0.4919000    
 H   -3.586100      -1.419300     -0.7779000    
 H   -3.494600      -1.589300      0.9760000    
 H   -2.785900      0.7951000       1.190900    
 H   -2.827800      0.9760000     -0.5594000    
 H   -1.035900     -0.9550000      0.9595000    
 H   -1.115900     -0.7839000     -0.8234000    
 H   0.8966000      -1.602800     -0.1035000    
 H    1.864600       2.599600      0.2683000    
 H    3.249700      -2.134400     -0.2659000    
 H    4.239100       2.055000      0.1031000    
 H    5.547100      -1.564500       1.877100    
 H    7.186900     -0.9938000       1.450300    
 H    5.966000      0.1772000       2.029800    


%chk=000043134-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043134

0 1
S 5.813846 -0.553515 -0.155759
O -0.529411 2.111446 0.184425
O 5.913198 -2.058630 -0.791524
O 6.571931 0.738397 -0.813775
N -5.127800 -0.361350 0.226900
C -5.649133 0.650460 -0.730079
C -6.131452 -1.457567 0.206074
C -7.173232 0.681888 -0.440621
C -7.491817 -0.715304 0.194568
C -3.744490 -0.810362 -0.013759
C -2.713020 0.319682 0.175138
C -1.272396 -0.209391 0.059796
C -0.211200 0.890273 0.108536
C 1.248741 0.496737 0.055798
C 1.669085 -0.858863 -0.015683
C 2.220831 1.534596 0.061125
C 3.963733 -0.123326 -0.032782
C 3.043014 -1.181715 -0.062828
C 3.596473 1.232326 0.010675
C 6.400755 -0.674576 1.665445
H -5.460037 0.338864 -1.791360
H -5.166216 1.630199 -0.574632
H -6.003277 -2.117526 1.083108
H -6.030326 -2.089385 -0.715414
H -7.751056 0.866680 -1.362979
H -7.412637 1.489761 0.271475
H -7.871638 -0.590413 1.222802
H -8.250812 -1.275734 -0.378650
H -3.627805 -1.246860 -1.045138
H -3.527712 -1.627085 0.704513
H -2.867842 0.788560 1.163847
H -2.864681 1.117352 -0.574274
H -1.065762 -0.941549 0.868411
H -1.144993 -0.772312 -0.890378
H 0.933627 -1.668478 -0.041560
H 1.868287 2.570402 0.098540
H 3.394962 -2.215022 -0.152820
H 4.361027 2.015631 -0.026079
H 5.820039 -1.477791 2.139033
H 7.469962 -0.919616 1.597356
H 6.228934 0.308413 2.124730


