%chk=000106354.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106354

0 1
 S   -2.702000     -0.8208000     -0.9077000    
 O   -2.445900      3.0500000E-02  -2.062500    
 O   -3.479900      -2.040500      -1.079700    
 O    1.210200       2.129800     -0.1611000    
 O   -4.682500       2.680000      0.2078000    
 N    2.278200      2.2500001E-02  4.2399999E-02
 N   -3.431900      0.1236000      0.3157000    
 N    3.569700     -0.4561000      2.2000000E-02
 C   -1.175300      -1.260100     -0.1837000    
 C    1.168800     -0.7891000      0.2171000    
 C  -5.8699999E-02 -0.4429000     -0.3595000    
 C    3.621500       1.860700     -0.2789000    
 C    2.196100       1.412900     -0.1311000    
 C    4.347900      0.5628000     -0.1577000    
 C   -1.072100      -2.429200      0.5703000    
 C    1.264200      -1.963800      0.9724000    
 C   -2.771200       1.349300      0.7865000    
 C   0.1477000      -2.781000       1.148400    
 C    5.831200      0.4780000     -0.2412000    
 C   -3.816000       2.333200       1.280500    
 H  -0.1541000      0.4366000     -0.9876000    
 H    3.902400       2.537300      0.5301000    
 H    3.789100       2.306600      -1.260900    
 H   -4.026900     -0.3564000       1.002700    
 H   -1.930000      -3.076900      0.7270000    
 H    2.202000      -2.255900       1.438700    
 H   -2.209400       1.807100     -3.4000002E-02
 H   -2.082400       1.100000       1.599200    
 H   0.2271000      -3.689500       1.738200    
 H    6.161500      0.8566000      -1.211900    
 H    6.161500     -0.5576000     -0.1268000    
 H    6.273900       1.087400      0.5509000    
 H   -3.340500       3.248300       1.645100    
 H   -4.419900       1.910000       2.089800    
 H   -5.086400       1.857400     -0.1180000    


%chk=000106354-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106354

0 1
S -2.860760 -0.825064 -0.723217
O -2.716600 0.150664 -2.010201
O -3.775012 -2.165306 -0.703956
O 1.332619 2.133086 -0.790354
O -5.309787 2.485184 0.510754
N 2.326057 0.071660 -0.089059
N -3.572961 0.252817 0.606019
N 3.643527 -0.423757 0.214472
C -1.115908 -1.334198 -0.161987
C 1.221435 -0.809241 0.064625
C -0.077297 -0.413951 -0.357298
C 3.812672 1.835952 -0.457800
C 2.332142 1.432887 -0.489319
C 4.493963 0.566452 0.005478
C -0.964727 -2.613201 0.395080
C 1.425581 -2.095511 0.634438
C -3.001242 1.616853 0.729843
C 0.342333 -2.982879 0.790519
C 5.965771 0.389361 0.219148
C -4.108285 2.513784 1.332291
H -0.245710 0.555334 -0.834167
H 3.970019 2.688169 0.227829
H 4.145459 2.165289 -1.459124
H -3.617660 -0.306145 1.474766
H -1.820543 -3.289281 0.483426
H 2.435361 -2.383016 0.934479
H -2.773207 1.965046 -0.293756
H -2.076885 1.661719 1.343270
H 0.517554 -3.974500 1.220000
H 6.526967 0.582138 -0.714669
H 6.184538 -0.636123 0.556944
H 6.345449 1.101632 0.975859
H -3.762569 3.561812 1.355163
H -4.327702 2.192754 2.375465
H -5.426691 1.540377 0.217541


