%chk=000002955.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002955

0 1
 S  -2.3000001E-03   1.619000      9.9999997E-05
 O  -2.3800001E-02   2.350000      -1.259200    
 O   6.1200000E-02   2.349000       1.259600    
 N   -4.831100      -1.850500      4.0000002E-03
 N    4.820700      -1.858400     -4.1000000E-03
 C   -1.420100      0.5999000      1.5000000E-03
 C    1.435400      0.5819000     -1.4000000E-03
 C   -1.985400      0.1926000       1.209900    
 C    1.978300      0.1896000      -1.209900    
 C   -1.987600      0.1932000      -1.206000    
 C    1.980500      0.1899000       1.206000    
 C   -3.118200     -0.6214000       1.210800    
 C    3.109800     -0.6263000      -1.210900    
 C   -3.120300     -0.6206000      -1.205300    
 C    3.111900     -0.6258000       1.205200    
 C   -3.685600      -1.028000      3.1999999E-03
 C    3.676600      -1.033900     -3.4000000E-03
 H   -1.556100      0.4927000       2.161700    
 H    1.546600      0.4912000      -2.159000    
 H   -1.560700      0.4906000      -2.159700    
 H    1.551200      0.4882000       2.157300    
 H   -3.548600     -0.9333000       2.158900    
 H    3.539500     -0.9390000      -2.159200    
 H   -3.552300     -0.9324000      -2.152800    
 H    3.543200     -0.9386000       2.152700    
 H   -5.241900      -2.145500      0.8798000    
 H   -5.243500      -2.144900     -0.8713000    
 H    5.230200      -2.155400     -0.8798000    
 H    5.231600      -2.154900      0.8711000    


%chk=000002955-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000002955

0 1
S 0.000915 1.657122 0.000268
O -0.000004 2.434847 -1.446281
O 0.003694 2.434442 1.447059
N -4.960543 -1.852940 0.007189
N 4.952083 -1.866065 -0.007618
C -1.511847 0.537839 0.002207
C 1.510124 0.534423 -0.001959
C -2.076291 0.171072 1.235908
C 2.073408 0.166139 -1.235750
C -2.074913 0.163959 -1.229987
C 2.072414 0.158923 1.230100
C -3.230964 -0.632267 1.236550
C 3.225756 -0.640483 -1.236642
C -3.229493 -0.639513 -1.227236
C 3.224675 -0.647823 1.227139
C -3.819368 -1.055778 0.005551
C 3.813176 -1.065720 -0.005763
H -1.633790 0.534127 2.169578
H 1.631735 0.530384 -2.169346
H -1.631720 0.521534 -2.165415
H 1.630380 0.517624 2.165640
H -3.689154 -0.927511 2.187764
H 3.682919 -0.936993 -2.187956
H -3.686544 -0.940367 -2.177240
H 3.681000 -0.950024 2.177064
H -5.396804 -2.137342 0.879308
H -5.395803 -2.142393 -0.863766
H 5.387444 -2.151602 -0.879818
H 5.386717 -2.156714 0.863253


