%chk=000035711.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035711

1 1
 S   -2.220300      -2.736200       1.332900    
 S   -1.775600      -3.532400     -0.5059000    
 N   0.1548000     -1.2300000E-02 -0.4172000    
 C  -0.9386000      -1.006100     -0.2515000    
 C    1.450100     -0.5860000      0.1392000    
 C  -0.1998000       1.262500      0.3347000    
 C   0.3335000      0.3036000      -1.895200    
 C   -1.111800      -1.306600       1.232100    
 C  -0.5707000      -2.275900      -1.008700    
 C    2.555900      0.4491000     -4.4999998E-03
 C   -1.512100       1.811200     -0.2056000    
 C    3.889800     -9.9799998E-02  0.5001000    
 C   -1.887000       3.119500      0.4892000    
 C    5.010500      0.9131000      0.3281000    
 C   -3.178700       3.696400     -6.7800000E-02
 H   -1.862300     -0.6212000     -0.6981000    
 H    1.753200      -1.471900     -0.4192000    
 H    1.355200     -0.8120000       1.200700    
 H   0.5660000       2.016200      0.1303000    
 H  -0.2132000       1.076900       1.413000    
 H   0.8221000       1.276200      -2.009600    
 H  -0.6433000      0.3303000      -2.388700    
 H   0.9491000     -0.4725000      -2.361700    
 H   -1.591500     -0.4937000       1.782900    
 H  -0.2262000      -1.621800       1.779800    
 H   0.3913000      -2.725000     -0.7686000    
 H  -0.6358000      -2.158700      -2.094100    
 H    2.357100       1.345600      0.5894000    
 H    2.695500      0.7588000      -1.044700    
 H   -2.350700       1.134000     -2.5200000E-02
 H   -1.464200       2.006700      -1.281200    
 H    3.807000     -0.3694000       1.559500    
 H    4.148900      -1.013500     -4.7800001E-02
 H   -2.001700       2.950400       1.566400    
 H   -1.083800       3.854400      0.3600000    
 H    5.954700      0.4990000      0.6956000    
 H    5.143500       1.177100     -0.7259000    
 H    4.801200       1.829800      0.8887000    
 H   -3.427000       4.631600      0.4437000    
 H   -3.085000       3.909600      -1.137500    
 H   -4.012500       3.001300      7.2800003E-02


%chk=000035711-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035711

1 1
S -2.679239 -2.581654 1.251524
S -2.066594 -3.581104 -0.786376
N 0.190248 -0.007057 -0.502833
C -0.899913 -1.123432 -0.284659
C 1.552948 -0.443282 0.107165
C -0.266768 1.320374 0.173715
C 0.349345 0.230307 -2.005290
C -1.206427 -1.398777 1.203218
C -0.552532 -2.464525 -0.967638
C 2.716702 0.550698 -0.050329
C -1.670839 1.825408 -0.195250
C 4.011678 -0.065311 0.547255
C -1.909777 3.219175 0.447146
C 5.210409 0.901284 0.447400
C -3.321322 3.762997 0.141628
H -1.810880 -0.720894 -0.762933
H 1.813823 -1.399626 -0.377395
H 1.365510 -0.633652 1.177627
H 0.486054 2.072004 -0.117137
H -0.177550 1.162088 1.262509
H 0.861353 1.189098 -2.167537
H -0.642836 0.259805 -2.478662
H 0.947615 -0.580500 -2.445031
H -1.547424 -0.503833 1.747083
H -0.361315 -1.870208 1.727890
H 0.309632 -2.966800 -0.502574
H -0.403769 -2.369596 -2.054967
H 2.509644 1.500426 0.476315
H 2.901892 0.790118 -1.114397
H -2.459227 1.137449 0.163846
H -1.786750 1.918650 -1.292177
H 3.839177 -0.331273 1.609321
H 4.251566 -1.008838 0.017672
H -1.770260 3.149328 1.544646
H -1.148889 3.933914 0.075073
H 6.118536 0.441838 0.873715
H 5.430641 1.163656 -0.603594
H 5.019317 1.838965 1.000549
H -3.468173 4.752050 0.608341
H -3.481709 3.879554 -0.945840
H -4.106296 3.089477 0.531382


