%chk=000178685.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178685

0 1
 S   -3.940100       1.512000     -0.3804000    
 S   -3.948300      -1.491000      0.3814000    
 S   -2.157100       3.912300     -0.7319000    
 S   -2.178300      -3.901100      0.7327000    
 N   -1.339000       1.263400     -0.2316000    
 N   -1.345900      -1.256800      0.2310000    
 C   -1.903200      4.8000002E-03 -1.9999999E-04
 C   -3.238400      8.5000005E-03  1.9999999E-04
 C   3.3199999E-02   1.600300     -3.7799999E-02
 C   2.4499999E-02  -1.601200      3.7099998E-02
 C   -2.319400       2.264500     -0.4830000    
 C   -2.331700      -2.252500      0.4833000    
 C   0.9430000       1.448200      -1.084200    
 C   0.9301000      -1.452900       1.084100    
 C   0.4656000       2.082000       1.197700    
 C   0.4491000      -2.083700      -1.197800    
 C    2.717500       2.259300      0.3407000    
 C    2.700000      -2.273400     -0.3409000    
 C    2.285200       1.777600     -0.8949000    
 C    2.270500      -1.789600      0.8948000    
 C    1.807600       2.411600       1.387100    
 C    1.789400      -2.420600      -1.387200    
 C    4.152500       2.611700      0.5433000    
 C    4.133200      -2.633600     -0.5436000    
 H   0.6165000       1.078300      -2.052700    
 H   0.6050000      -1.081300       2.052300    
 H  -0.2333000       2.201900       2.021600    
 H  -0.2509000      -2.199500      -2.021100    
 H    2.984000       1.655900      -1.718200    
 H    2.970100      -1.671700       1.718000    
 H    2.131800       2.786500       2.354100    
 H    2.111500      -2.797100      -2.354400    
 H    4.448500       2.481500       1.589800    
 H    4.804300       1.966900     -5.6000002E-02
 H    4.327800       3.653200      0.2566000    
 H    4.429700      -2.505400      -1.590200    
 H    4.788600      -1.991900      5.5300001E-02
 H    4.303000      -3.675900     -0.2565000    


%chk=000178685-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178685

0 1
S -4.065203 1.668567 -0.024670
S -4.075660 -1.642971 0.024714
S -2.011534 4.015585 -0.074128
S -2.037031 -4.002949 0.074169
N -1.422317 1.290351 -0.011743
N -1.430454 -1.281472 0.012342
C -2.012596 0.006294 0.000240
C -3.389799 0.010651 0.000104
C 0.004780 1.579505 0.033845
C -0.005175 -1.579533 -0.033481
C -2.339816 2.364800 -0.035015
C -2.354750 -2.350077 0.035733
C 0.780462 1.505542 -1.140497
C 0.771353 -1.509386 1.140535
C 0.578707 2.004111 1.250401
C 0.565881 -2.007947 -1.250060
C 2.755812 2.258759 0.126972
C 2.741940 -2.274308 -0.127303
C 2.150538 1.835685 -1.084786
C 2.139522 -1.847286 1.084484
C 1.947594 2.336647 1.291377
C 1.932855 -2.348195 -1.291370
C 4.221066 2.653472 0.167735
C 4.204976 -2.677111 -0.168489
H 0.316872 1.201093 -2.084377
H 0.309853 -1.201723 2.084395
H -0.045344 2.086972 2.145823
H -0.058947 -2.087598 -2.145231
H 2.755952 1.769987 -1.996242
H 2.745647 -1.784497 1.995671
H 2.393231 2.668749 2.236289
H 2.376286 -2.683217 -2.236293
H 4.653285 2.509877 1.173259
H 4.820055 2.067780 -0.551541
H 4.347688 3.721870 -0.094203
H 4.637791 -2.535527 -1.174048
H 4.807332 -2.095006 0.550885
H 4.325750 -3.746296 0.093004


