%chk=000163778.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163778

0 1
 S  -4.7899999E-02   1.455800      -1.882700    
 S   4.1000001E-02   1.703200       1.621700    
 P  -8.9999998E-04  0.5625000      3.4899998E-02
 C    2.781700      7.5999998E-02  9.1000004E-03
 C   -2.780900      7.6200001E-02  3.5300002E-02
 C    1.396600     -0.5873000     -3.0400001E-02
 C   -1.395400     -0.5877000      4.0199999E-02
 C    3.895400     -0.9962000      7.2600000E-02
 C   -3.894200     -0.9918000     -8.3999999E-02
 C    5.364600     -0.4877000      0.1415000    
 C   -5.363500     -0.4809000     -0.1265000    
 C    2.943800      0.9963000      -1.205600    
 C   -2.943300      0.9319000       1.296300    
 C    6.295900      -1.478200      0.8534000    
 C    5.372300      0.8380000      0.9313000    
 C    5.910100     -0.2066000      -1.270700    
 C   -6.294300      -1.433400     -0.8889000    
 C   -5.371800      0.8841000     -0.8460000    
 C   -5.909200     -0.2740000       1.298500    
 H    2.827800      0.6873000      0.9154000    
 H   -2.825100      0.7340000     -0.8384000    
 H    1.300400      -1.210700     -0.9280000    
 H    1.301900      -1.265400      0.8270000    
 H   -1.300400      -1.233000     -0.8417000    
 H   -1.300300      -1.246100      0.9129000    
 H    3.786800      -1.694200     -0.7681000    
 H    3.704200      -1.596700      0.9732000    
 H   -3.703200      -1.540400      -1.017400    
 H   -3.783000      -1.737900      0.7138000    
 H    3.925700       1.435700      -1.315600    
 H    2.712800      0.4815000      -2.143100    
 H    2.329800       1.888400      -1.082600    
 H   -3.968900       1.155700       1.560100    
 H   -2.518200      0.4472000       2.180500    
 H   -2.528600       1.928000       1.135000    
 H    6.321600      -2.435700      0.3214000    
 H    5.955500      -1.675000       1.876200    
 H    7.322500      -1.099900      0.9134000    
 H    4.927100      0.7057000       1.924600    
 H    4.881800       1.682000      0.4464000    
 H    6.407500       1.163400       1.098400    
 H    5.631200      0.7524000      -1.702800    
 H    5.623800     -0.9981000      -1.972000    
 H    7.007700     -0.1902000      -1.253000    
 H   -6.319600      -2.417800     -0.4084000    
 H   -5.953800      -1.576000      -1.920600    
 H   -7.320700      -1.051800     -0.9296000    
 H   -4.929600      0.8050000      -1.846200    
 H   -4.869900       1.692400     -0.3106000    
 H   -6.405600       1.224400     -0.9893000    
 H   -5.921500      0.7730000       1.616000    
 H   -5.360200     -0.8592000       2.043800    
 H   -6.955500     -0.5978000       1.366700    
 H   -1.144200       2.208000      -1.709800    


%chk=000163778-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163778

0 1
S -0.572536 1.774658 -2.079452
S 0.489822 2.279934 1.480057
P 0.014814 0.873650 0.005696
C 2.855422 0.299717 -0.265726
C -2.866289 0.295646 0.261884
C 1.437905 -0.292630 -0.458481
C -1.436614 -0.293861 0.359720
C 3.864014 -0.888960 -0.253939
C -3.858221 -0.908863 0.242807
C 5.366376 -0.620290 0.110924
C -5.378847 -0.650965 -0.045278
C 3.146243 1.382991 -1.330223
C -3.132375 1.323750 1.386822
C 5.982728 -1.986744 0.529587
C 5.488798 0.366670 1.301020
C 6.179916 -0.091373 -1.103311
C -5.992591 -2.009594 -0.492192
C -5.568961 0.380402 -1.188072
C -6.146900 -0.183611 1.222587
H 2.870953 0.784832 0.731363
H -2.938202 0.810073 -0.717693
H 1.263307 -0.601664 -1.506506
H 1.294362 -1.176647 0.195023
H -1.312174 -1.109987 -0.379778
H -1.240593 -0.703241 1.370171
H 3.834278 -1.398570 -1.241455
H 3.484860 -1.625991 0.486662
H -3.500174 -1.609053 -0.542427
H -3.776907 -1.455744 1.207075
H 4.062697 1.946630 -1.089381
H 3.270459 0.931458 -2.333190
H 2.318568 2.111555 -1.387710
H -4.060358 1.889789 1.199384
H -3.231680 0.819440 2.367216
H -2.304451 2.050531 1.470485
H 5.855707 -2.741548 -0.270293
H 5.502713 -2.378116 1.446732
H 7.066106 -1.884316 0.729047
H 4.891779 0.025186 2.168008
H 5.145478 1.382119 1.032564
H 6.542969 0.446352 1.627240
H 5.824403 0.891158 -1.454748
H 6.120550 -0.797556 -1.953670
H 7.246881 0.016615 -0.829016
H -5.824905 -2.791667 0.273124
H -5.542595 -2.358912 -1.440904
H -7.084079 -1.915625 -0.646549
H -5.009543 0.082346 -2.095205
H -5.227020 1.389256 -0.893170
H -6.638481 0.458109 -1.460408
H -5.791957 0.790454 1.597374
H -6.039507 -0.921157 2.040925
H -7.226321 -0.084098 0.998537
H -0.860029 3.015863 -1.535662


