%chk=000070927.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070927

0 1
 S    2.940300       1.079300     -3.0000001E-04
 S    4.565900     -0.2416000     -1.3900000E-02
 O    5.872300      0.7331000     -3.0200001E-02
 O    4.556500     -0.9544000       1.249200    
 O    4.529900     -0.9606000      -1.272900    
 N  -0.9147000     -0.1847000      4.4100001E-02
 C   -3.353200     -0.4305000      2.4499999E-02
 C   -4.689200      0.3142000     -2.2600001E-02
 C   -2.177100      0.5446000      1.9500000E-02
 C   -5.869000     -0.6567000      1.8100001E-02
 C   0.2156000      0.7330000      2.9300001E-02
 C    1.520500     -5.3500000E-02  1.7600000E-02
 C   -7.197800      7.7799998E-02 -6.2300000E-02
 H   -3.281200      -1.105400     -0.8378000    
 H   -3.314400      -1.054000      0.9267000    
 H   -4.755900       1.006400      0.8255000    
 H   -4.740000      0.9177000     -0.9371000    
 H   -2.250000       1.206900      0.8909000    
 H   -2.232100       1.167100     -0.8818000    
 H   -5.799000      -1.363300     -0.8171000    
 H   -5.836600      -1.243600      0.9434000    
 H  -0.8718000     -0.7744000      0.8749000    
 H   0.1787000       1.383400      0.9124000    
 H   0.1632000       1.368500     -0.8637000    
 H    1.574700     -0.6965000     -0.8675000    
 H    1.595200     -0.6909000      0.9053000    
 H   -8.027500     -0.6353000     -3.0400001E-02
 H   -7.313800      0.7717000      0.7764000    
 H   -7.275400      0.6478000     -0.9936000    
 H    5.922500       1.358600     -0.7907000    


%chk=000070927-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070927

0 1
S 3.412769 -0.041018 1.413887
S 3.486679 0.057738 -1.055747
O 2.870326 1.822790 -1.210625
O 4.973379 -0.004422 -1.685468
O 2.331379 -0.911786 -1.652221
N -0.733786 -0.207501 1.195734
C -3.080795 -0.379380 0.386770
C -4.242620 0.328720 -0.345076
C -1.807688 0.486560 0.462869
C -5.522959 -0.534815 -0.418668
C 0.600323 0.400836 1.239362
C 1.657417 -0.708209 1.420395
C -6.684780 0.175244 -1.146160
H -2.833362 -1.330816 -0.122440
H -3.408430 -0.643618 1.415438
H -4.477580 1.285345 0.166822
H -3.923552 0.595199 -1.374105
H -2.061656 1.473832 0.922678
H -1.437930 0.698789 -0.559338
H -5.289364 -1.488686 -0.933483
H -5.838961 -0.805364 0.609718
H -1.041745 -0.630584 2.079533
H 0.727621 1.162042 2.045017
H 0.775401 0.918456 0.279125
H 1.564355 -1.477854 0.631060
H 1.558384 -1.206170 2.404310
H -7.587955 -0.460997 -1.182817
H -6.956003 1.118156 -0.634737
H -6.406431 0.426512 -2.187000
H 3.114162 2.145702 -2.128935


