%chk=000131927.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131927

0 1
 S   0.3735000      -3.702900     -5.7100002E-02
 F    1.883000       1.238100       2.208600    
 N   -2.822000      0.1633000     -9.4599999E-02
 N   -5.476300       1.180400      0.1689000    
 N  -0.5097000      0.5998000     -0.1288000    
 N   -1.352400      -1.673100     -7.5099997E-02
 C   -3.853100     -0.6360000      0.5809000    
 C   -3.061200       1.610200     -0.1308000    
 C   -5.242800     -0.2595000      6.8899997E-02
 C   -4.479900       1.907000     -0.6161000    
 C   -1.509800     -0.3234000     -9.9500000E-02
 C    1.041400      -1.209800     -0.1119000    
 C   0.7674000      0.1615000     -0.1349000    
 C  -6.0300000E-02  -2.055100     -8.3200000E-02
 C    2.259300      -1.960200     -0.1116000    
 C    1.811300       1.149300     -0.1673000    
 C    2.040700      -3.320600     -8.3400004E-02
 C    2.340500       1.663500       1.021800    
 C    2.306000       1.608500      -1.393200    
 C    3.038100      -4.412500     -7.7399999E-02
 C    3.351000       2.624500      0.9855000    
 C    3.316400       2.569500      -1.429500    
 C    3.838900       3.077500     -0.2402000    
 H   -3.787900     -0.4705000       1.664000    
 H   -3.720400      -1.709600      0.4036000    
 H   -2.367300       2.108600     -0.8187000    
 H   -2.903400       2.033200      0.8694000    
 H   -5.364300     -0.5860000     -0.9716000    
 H   -5.999400     -0.7863000      0.6606000    
 H   -4.671600       2.982200     -0.5314000    
 H   -4.578900       1.646200      -1.677500    
 H   -6.407200       1.395600     -0.1871000    
 H    3.250200      -1.522800     -0.1316000    
 H    1.909800       1.224300      -2.330700    
 H    4.058300      -4.014600     -9.4400004E-02
 H    2.938800      -5.029500      0.8220000    
 H    2.919800      -5.056600     -0.9552000    
 H    3.757700       3.019600       1.911600    
 H    3.696400       2.922400      -2.383800    
 H    4.625600       3.825700     -0.2684000    


%chk=000131927-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131927

0 1
S 0.272363 -3.857048 0.392726
F 3.332519 0.231340 1.536909
N -2.862727 0.216833 0.427038
N -5.358497 1.096542 -0.587272
N -0.544811 0.602613 0.178235
N -1.430212 -1.661978 0.437906
C -4.051160 -0.648588 0.563532
C -3.152557 1.662423 0.352893
C -5.044572 -0.350429 -0.581007
C -4.155431 1.934879 -0.789555
C -1.582068 -0.292239 0.343608
C 1.002716 -1.273268 0.192374
C 0.733029 0.129119 0.120015
C -0.164668 -2.096362 0.351153
C 2.221438 -2.047898 0.082833
C 1.780737 1.169092 -0.101383
C 2.040963 -3.411365 0.165445
C 3.029831 1.207235 0.559574
C 1.516741 2.234577 -1.006769
C 3.062182 -4.509930 0.103541
C 3.996766 2.202062 0.338882
C 2.466010 3.245719 -1.256746
C 3.713545 3.228518 -0.587876
H -4.545047 -0.432867 1.532317
H -3.721880 -1.697894 0.548275
H -2.204910 2.198577 0.197648
H -3.607097 1.986251 1.310840
H -4.588034 -0.699442 -1.540290
H -5.975429 -0.921994 -0.413032
H -4.449489 3.000202 -0.770014
H -3.642280 1.731381 -1.762542
H -6.126058 1.336569 -1.226074
H 3.209975 -1.603803 -0.043251
H 0.542444 2.242199 -1.504486
H 4.069118 -4.079711 -0.035799
H 3.075403 -5.110107 1.033069
H 2.868694 -5.205257 -0.735132
H 4.936573 2.170190 0.897736
H 2.235858 4.044954 -1.968688
H 4.456222 4.010806 -0.775832


