%chk=000178584.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178584

0 1
 S  -0.5126000      -2.553100      0.7494000    
 P  -5.5999998E-03 -0.7462000     -0.2286000    
 O  -6.1000001E-02 -0.9882000      -1.718700    
 N   -1.053600      0.4181000      0.3326000    
 N    1.499100     -0.3158000      0.3426000    
 C   -2.467600      0.3320000      4.6999999E-03
 C    2.058600      0.9726000     -4.0700000E-02
 C   -3.154500       1.670100      0.2664000    
 C    3.546300       1.026100      0.2975000    
 C   -4.640800       1.600600     -4.8799999E-02
 C    4.150700       2.371400     -7.3899999E-02
 C   0.6410000      -3.787700      0.1176000    
 H   -2.586700      6.8000004E-02  -1.052100    
 H   -2.939100     -0.4582000      0.5986000    
 H    1.926400       1.124400      -1.118000    
 H    1.524100       1.777000      0.4764000    
 H  -0.9514000      0.6820000       1.312200    
 H    1.650700     -0.4568000       1.341200    
 H   -3.027700       1.960600       1.316400    
 H   -2.693800       2.455600     -0.3449000    
 H    3.696200      0.8538000       1.370400    
 H    4.082300      0.2317000     -0.2360000    
 H   -4.807400       1.344900      -1.100200    
 H   -5.138700      0.8482000      0.5712000    
 H   -5.114900       2.568000      0.1447000    
 H    4.049500       2.564100      -1.146700    
 H    3.660300       3.185300      0.4696000    
 H    5.216200       2.389900      0.1756000    
 H    1.667700      -3.494000      0.3497000    
 H   0.5317000      -3.881200     -0.9656000    
 H   0.4352000      -4.756000      0.5804000    


%chk=000178584-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178584

0 1
S 0.337650 -2.940063 1.635249
P 0.308772 -0.918061 0.460586
O 0.345545 -1.189365 -1.125092
N -1.009500 0.119485 0.870407
N 1.602799 -0.147471 1.324575
C -2.258794 0.171085 0.087385
C 2.080767 1.213543 0.977035
C -2.797198 1.615168 -0.010534
C 3.068266 1.255724 -0.214259
C -4.125550 1.680777 -0.794744
C 3.534959 2.694600 -0.523018
C 0.269160 -4.084866 0.129197
H -2.028827 -0.215357 -0.922334
H -3.036165 -0.488340 0.530036
H 1.193446 1.833654 0.748969
H 2.553664 1.644755 1.881468
H -1.049235 0.439690 1.842150
H 2.310057 -0.801054 1.676434
H -2.948236 2.022635 1.010310
H -2.029586 2.246458 -0.496345
H 3.944423 0.616168 0.014600
H 2.573971 0.812274 -1.099878
H -3.997872 1.298802 -1.824724
H -4.910260 1.074068 -0.304887
H -4.495766 2.719391 -0.863324
H 2.676875 3.344939 -0.777646
H 4.054912 3.145183 0.343863
H 4.232689 2.710360 -1.379282
H 1.150051 -4.742977 0.154887
H 0.291162 -3.455205 -0.778943
H -0.661581 -4.668798 0.170860


