%chk=000020019.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020019

0 1
 S   -2.740200      -1.114100      -1.042800    
 S    2.741000      -1.112700       1.044100    
 N   -1.153000      0.9607000     -0.2550000    
 N    1.153200      0.9611000      0.2549000    
 C  -0.5853000       2.289400     -0.4842000    
 C   0.5859000       2.290300      0.4819000    
 C    0.000000      8.8000000E-02  1.1000000E-03
 C   -1.983600      0.5069000      -1.359400    
 C    1.985100      0.5091000       1.359000    
 C   -3.620800     -0.7330000      0.4926000    
 C    3.619700     -0.7344000     -0.4930000    
 C   -4.365600      -1.954400      0.9969000    
 C    4.363600      -1.956800     -0.9962000    
 H   -1.304100       3.081500     -0.2531000    
 H  -0.2311000       2.416300      -1.515900    
 H    1.304700       3.081900      0.2494000    
 H   0.2319000       2.419000       1.513400    
 H  -0.2453000     -0.5504000      0.8584000    
 H   0.2451000     -0.5529000     -0.8544000    
 H   -1.411200      0.4357000      -2.291900    
 H   -2.798500       1.217900      -1.535500    
 H    1.413900      0.4396000       2.292300    
 H    2.800400       1.220300       1.532900    
 H   -2.913600     -0.4106000       1.262400    
 H   -4.330100      8.0200002E-02  0.3094000    
 H    2.911800     -0.4132000      -1.262600    
 H    4.329400      7.9000004E-02 -0.3120000    
 H   -5.109700      -2.300000      0.2713000    
 H   -3.681000      -2.781400       1.214900    
 H   -4.896100      -1.711500       1.923700    
 H    5.108600      -2.301400     -0.2709000    
 H    3.678700      -2.784000      -1.211800    
 H    4.893000      -1.715600      -1.924000    


%chk=000020019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020019

0 1
S -3.171032 -1.326264 -0.949834
S 3.170804 -1.325676 0.950828
N -1.055560 0.473194 -0.493831
N 1.055342 0.473553 0.493700
C -0.504374 1.849181 -0.581907
C 0.504708 1.849861 0.579816
C -0.000601 -0.442915 0.001328
C -1.919376 -0.003414 -1.548037
C 1.919960 -0.001543 1.547923
C -4.039441 -0.292371 0.382840
C 4.038650 -0.294089 -0.384000
C -4.749861 -1.213799 1.385197
C 4.749432 -1.217125 -1.384625
H -1.301551 2.603563 -0.453443
H 0.021831 2.044902 -1.545147
H 1.302195 2.603715 0.450228
H -0.021390 2.047233 1.542787
H -0.402549 -1.101318 0.804945
H 0.400609 -1.104207 -0.800237
H -1.393110 -0.525397 -2.378515
H -2.494380 0.842917 -1.960098
H 1.394238 -0.522009 2.379690
H 2.495495 0.845324 1.958127
H -3.240105 0.299995 0.863312
H -4.752131 0.387994 -0.115899
H 3.238948 0.296890 -0.865573
H 4.751058 0.387620 0.113310
H -5.514710 -1.838904 0.890073
H -4.028301 -1.885864 1.882270
H -5.256314 -0.612264 2.163571
H 5.514684 -1.840835 -0.888369
H 4.028168 -1.890569 -1.880261
H 5.255465 -0.616877 -2.164268


