%chk=000059866.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059866

0 1
 Cl  -7.064000      0.1685000      0.5794000    
 S   -1.733900       1.599700      0.2723000    
 N   0.6170000      0.5010000     -0.2415000    
 N    1.050800       1.752900     -1.6400000E-02
 N   -1.316600     -0.8752000     -0.3218000    
 C    2.745400      0.3573000     -0.5166000    
 C    4.144300     -0.1376000     -0.7850000    
 C    4.823200     -0.6257000      0.4978000    
 C    1.611800     -0.3802000     -0.5485000    
 C    2.371300       1.652000     -0.1895000    
 C    6.253000      -1.092700      0.2253000    
 C    1.365800      -1.808000     -0.8326000    
 C  -0.7361000      0.2792000     -0.1353000    
 C    3.217600       2.846800     -2.4200000E-02
 C    6.945900      -1.540800       1.502300    
 C   -3.105900      0.5578000      0.2022000    
 C   -2.683400     -0.7325000     -0.1319000    
 C   -4.458700      0.8604000      0.4261000    
 C   -3.651500      -1.754200     -0.2455000    
 C   -5.396200     -0.1688000      0.3075000    
 C   -5.000000      -1.459800     -2.4000000E-02
 H    4.734500      0.6724000      -1.231500    
 H    4.119900     -0.9431000      -1.528600    
 H    4.836800      0.1810000       1.241600    
 H    4.244400      -1.448400      0.9363000    
 H    6.243000      -1.922600     -0.4907000    
 H    6.830800     -0.2790000     -0.2285000    
 H    2.299500      -2.342700      -1.033400    
 H   0.8940000      -2.305200      2.1100000E-02
 H   0.7290000      -1.930700      -1.714700    
 H    2.640600       3.710700      0.3227000    
 H    4.009900       2.661200      0.7082000    
 H    3.686800       3.118300     -0.9754000    
 H    6.410000      -2.374500       1.967200    
 H    7.002300     -0.7217000       2.226400    
 H    7.965900      -1.872100       1.283900    
 H   -4.762600       1.870800      0.6850000    
 H   -3.352600      -2.766200     -0.5037000    
 H   -5.732100      -2.258800     -0.1151000    


%chk=000059866-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000059866

0 1
Cl -7.305412 0.196318 0.575220
S -1.838686 1.730746 0.348160
N 0.564943 0.460611 -0.230478
N 1.061161 1.756435 0.027954
N -1.444158 -0.869488 -0.332655
C 2.778462 0.294347 -0.530348
C 4.179352 -0.203461 -0.785759
C 4.938750 -0.610151 0.509033
C 1.589426 -0.446921 -0.571486
C 2.401004 1.641591 -0.155601
C 6.386834 -1.072163 0.230342
C 1.349488 -1.889527 -0.896561
C -0.808439 0.265183 -0.125182
C 3.292797 2.836779 0.023863
C 7.146653 -1.467446 1.514672
C -3.258349 0.602128 0.228539
C -2.831089 -0.716468 -0.142212
C -4.614334 0.904612 0.452879
C -3.789171 -1.746154 -0.289750
C -5.535621 -0.149255 0.295582
C -5.151372 -1.460853 -0.069463
H 4.763188 0.583601 -1.304015
H 4.156933 -1.071875 -1.472927
H 4.953117 0.247087 1.212049
H 4.379252 -1.419618 1.019739
H 6.367615 -1.931866 -0.470460
H 6.934315 -0.259767 -0.290343
H 2.305797 -2.371878 -1.158530
H 0.901486 -2.430768 -0.044383
H 0.645398 -2.007526 -1.738486
H 2.689551 3.725296 0.270071
H 4.023944 2.674991 0.837533
H 3.867929 3.048338 -0.896793
H 6.637446 -2.298796 2.037523
H 7.205035 -0.615701 2.218247
H 8.179315 -1.791677 1.290304
H -4.951323 1.904808 0.735688
H -3.462270 -2.750503 -0.572808
H -5.909070 -2.241509 -0.178258


