%chk=000129423.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129423

0 1
 S   -3.956800      0.7997000     -0.1843000    
 O   -3.632700       2.116000     -0.7163000    
 O   -4.973300     -1.3800000E-02 -0.8370000    
 O    2.671100      -1.337200      0.3240000    
 N    1.154200      0.4248000      0.2001000    
 N   -4.359200      0.9572000       1.468800    
 N    3.387000      0.8446000      0.3692000    
 N    5.569700       1.547100     -4.3400001E-02
 N    4.999500     -0.5442000     -0.7556000    
 C   -2.483500     -0.1310000     -8.1000000E-02
 C  -9.2699997E-02 -0.2340000      9.9500000E-02
 C   -1.253100      0.5188000      1.8500000E-02
 C   -2.536600      -1.524900     -9.8499998E-02
 C  -0.1294000      -1.619100      8.3400004E-02
 C   -1.359600      -2.268900     -1.6200000E-02
 C    2.420000     -0.1360000      0.2884000    
 C    4.575200      0.6009000     -0.1194000    
 H   -1.200000       1.604100      3.9500002E-02
 H   -3.483900      -2.051800     -0.1691000    
 H   0.7346000      -2.264300      0.1408000    
 H   -1.402500      -3.354200     -2.8800000E-02
 H    1.116900       1.441300      0.2027000    
 H   -4.254200       1.884300       1.898800    
 H   -5.168600      0.4277000       1.815100    
 H    6.495600       1.374500     -0.4193000    
 H    5.404400       2.446600      0.3952000    
 H    4.383600      -1.336100     -0.9024000    
 H    5.949100     -0.6307000      -1.101300    


%chk=000129423-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129423

0 1
S -4.017165 0.869392 0.021322
O -3.601607 2.382101 -0.425151
O -5.233718 0.035174 -0.669040
O 2.725322 -1.413217 -0.169615
N 1.180198 0.372415 -0.091644
N -4.412997 0.962726 1.820430
N 3.406983 0.895877 -0.126834
N 5.580969 1.698548 -0.158464
N 5.254448 -0.647302 -0.206420
C -2.465596 -0.196329 -0.032746
C -0.049894 -0.313304 -0.086719
C -1.237166 0.470618 -0.030728
C -2.618715 -1.589060 -0.097368
C -0.157011 -1.733426 -0.138654
C -1.425927 -2.347681 -0.149180
C 2.481452 -0.145400 -0.133374
C 4.725469 0.617705 -0.164495
H -1.207283 1.566382 -0.012433
H -3.609839 -2.049608 -0.130797
H 0.760334 -2.323744 -0.179808
H -1.487516 -3.439802 -0.201634
H 1.161720 1.394943 -0.066789
H -4.387379 1.958567 2.096761
H -5.338461 0.524770 1.962845
H 6.592271 1.604666 -0.184847
H 5.154245 2.621228 -0.129729
H 4.546815 -1.405351 -0.207942
H 6.254847 -0.829489 -0.235547


