%chk=000019510.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019510

0 1
 S  -0.3189000      5.6800000E-02  -2.491500    
 P  -8.6199999E-02  1.5000000E-02 -0.5134000    
 N   -1.589100      1.2400000E-02  0.2855000    
 N   0.7427000       1.348400      0.1145000    
 N   0.7184000      -1.356300      6.2500000E-02
 C   -2.459400       1.187400      0.1354000    
 C   -2.427000      -1.191300      0.1892000    
 C    2.095200       1.662200     -0.3546000    
 C   0.6457000       1.719400       1.528600    
 C    2.065500      -1.676300     -0.4179000    
 C   0.6130000      -1.777700       1.461800    
 H   -3.239400       1.193700      0.9047000    
 H   -2.938700       1.208800     -0.8492000    
 H   -1.898700       2.119300      0.2476000    
 H   -2.921700      -1.252300     -0.7864000    
 H   -3.195200      -1.190800      0.9704000    
 H   -1.852000      -2.111700      0.3139000    
 H    2.310500       2.729100     -0.2277000    
 H    2.205900       1.449000      -1.421300    
 H    2.855700       1.092800      0.1868000    
 H  -0.3673000       1.611200       1.921300    
 H   0.9210000       2.769900       1.675700    
 H    1.305100       1.101000       2.145400    
 H    2.835500      -1.131300      0.1351000    
 H    2.175800      -1.438000      -1.479300    
 H    2.266500      -2.748900     -0.3181000    
 H  -0.3705000      -1.591100       1.896100    
 H    1.341300      -1.250600       2.086800    
 H   0.7956000      -2.854100       1.554500    


%chk=000019510-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019510

0 1
S 0.335889 0.026251 -2.541672
P 0.141737 -0.000598 -0.451141
N -1.485601 -0.002174 0.259010
N 0.790776 1.463101 0.280225
N 0.778274 -1.488561 0.240950
C -2.277735 1.236065 0.059609
C -2.288630 -1.228025 0.029262
C 1.799687 2.265523 -0.428807
C 0.697174 1.711669 1.729424
C 1.772350 -2.287029 -0.492839
C 0.688905 -1.768610 1.684466
H -3.091783 1.260451 0.807351
H -2.725544 1.284118 -0.956674
H -1.636707 2.120321 0.199580
H -2.732013 -1.250036 -0.989885
H -3.106577 -1.260227 0.772422
H -1.657066 -2.121421 0.153524
H 1.556753 3.342201 -0.329620
H 1.794093 2.002879 -1.500613
H 2.821235 2.099294 -0.024082
H -0.152229 1.155360 2.158371
H 0.524514 2.792295 1.905376
H 1.626813 1.424621 2.267694
H 2.797298 -2.147760 -0.086677
H 1.768275 -1.994516 -1.556910
H 1.512921 -3.362193 -0.422869
H -0.154526 -1.215084 2.128423
H 1.622766 -1.500533 2.225199
H 0.508253 -2.851385 1.837304


