%chk=000039974.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039974

0 1
 Cl -7.3600002E-02  -2.332400      0.4975000    
 S    2.757300      -1.640800     -2.4100000E-02
 N   -2.457200      0.9234000      0.7745000    
 N  -0.1778000      0.8769000      0.3164000    
 N   -1.767600     -0.3921000     -0.9412000    
 C   -3.706400      0.3783000      0.3382000    
 C   -3.252700     -0.5117000     -0.8259000    
 C   -1.434000      0.4441000      1.2700000E-02
 C    1.038800      0.2022000      0.1523000    
 C    2.241800      0.8750000     -9.3000002E-02
 C    1.136300      -1.145300      0.2193000    
 C    3.280700     -2.1500001E-02 -0.2132000    
 C    2.414600       2.343800     -0.2134000    
 H   -4.390800       1.162400      1.8000000E-03
 H   -4.185600     -0.2073000       1.128100    
 H   -3.521100      -1.558300     -0.6469000    
 H   -3.717400     -0.1951000      -1.765700    
 H   -2.365300       1.569200       1.548800    
 H  -0.1306000       1.834200      0.6613000    
 H    4.324000      0.1902000     -0.4027000    
 H    2.178900       2.836300      0.7358000    
 H    3.442300       2.610000     -0.4825000    
 H    1.753300       2.748100     -0.9870000    


%chk=000039974-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039974

0 1
Cl 0.173116 -2.487173 1.147495
S 2.923764 -1.744734 -0.072450
N -2.518333 1.017924 0.873248
N -0.137819 0.758320 0.759167
N -1.620877 -0.249194 -0.866529
C -3.733784 0.530632 0.164737
C -3.109324 -0.332649 -1.005575
C -1.392905 0.461949 0.213159
C 1.063501 0.103661 0.390298
C 2.217648 0.820495 -0.145546
C 1.294445 -1.259081 0.509026
C 3.283091 -0.014532 -0.423138
C 2.206091 2.312990 -0.381261
H -4.335113 1.374008 -0.218539
H -4.370845 -0.077093 0.835028
H -3.431697 -1.389871 -0.961064
H -3.403830 0.064978 -1.993190
H -2.522760 1.083327 1.893804
H -0.057496 1.651612 1.247067
H 4.255629 0.239335 -0.840757
H 2.128574 2.880885 0.566914
H 3.129671 2.642020 -0.885901
H 1.347154 2.601793 -1.014892


