%chk=000120956.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000120956

0 1
 Cl   4.546400       1.831400      -1.359000    
 N  -0.2924000      0.1256000     -0.9021000    
 N    2.463400     -5.7900000E-02 -0.1735000    
 C   0.2380000      0.9271000      0.2074000    
 C   0.7385000     -4.3000001E-02  -1.933800    
 C    1.453700      0.2491000      0.8441000    
 C    1.969900     -0.7543000      -1.368300    
 C   -1.484700      0.7565000      -1.466900    
 C   -2.579800      0.9029000     -0.4440000    
 C    3.792500     -0.2704000      0.2095000    
 C   -3.540000     -9.6600004E-02 -0.2447000    
 C   -2.597700       2.079600      0.2987000    
 C   -4.543900      0.1018000      0.7330000    
 C    4.853300      0.5307000     -0.2644000    
 C    4.105800      -1.316900       1.101100    
 C   -3.531700      -1.287900     -0.9884000    
 C   -3.584700       2.274500       1.260400    
 C   -4.552200       1.292900       1.477100    
 C    6.168400      0.2948000      0.1366000    
 C    5.420900      -1.552800       1.501800    
 C   -5.509900     -0.8968000      0.9380000    
 C   -4.499400      -2.269200     -0.7717000    
 C    6.452100     -0.7471000       1.019500    
 C   -5.486600      -2.074000      0.1896000    
 H  -0.4754000       1.020000       1.029700    
 H   0.5146000       1.935400     -0.1284000    
 H    1.035500      0.9297000      -2.348600    
 H   0.3464000     -0.6456000      -2.762100    
 H    1.873400      0.9202000       1.603900    
 H    1.146200     -0.6748000       1.350700    
 H    1.722500      -1.791700      -1.108900    
 H    2.743700     -0.7867000      -2.145100    
 H   -1.842600      0.2148000      -2.349500    
 H   -1.235500       1.752900      -1.863300    
 H   -1.866500       2.866600      0.1346000    
 H    3.319000      -1.962200       1.486200    
 H   -2.778900      -1.507800      -1.738800    
 H   -3.605100       3.193000       1.839700    
 H   -5.314900       1.467100       2.233200    
 H   -6.290700     -0.7658000       1.684400    
 H    6.983700      0.9134000     -0.2300000    
 H    5.642200      -2.364700       2.188300    
 H   -4.479900      -3.188100      -1.350500    
 H    7.476100     -0.9312000       1.331400    
 H   -6.239000      -2.838900      0.3586000    


%chk=000120956-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000120956

0 1
Cl 4.733648 1.057059 -2.038203
N -0.319078 0.459373 -0.941877
N 2.424247 -0.070901 -0.213983
C 0.221333 0.877003 0.373950
C 0.754159 0.451408 -1.968152
C 1.361845 -0.058513 0.814250
C 1.893783 -0.484021 -1.539349
C -1.482365 1.278232 -1.380808
C -2.676007 1.243090 -0.433932
C 3.736957 -0.442415 0.161543
C -3.383156 0.013583 -0.147747
C -3.139167 2.441649 0.124105
C -4.561389 0.056840 0.699336
C 4.892745 -0.048013 -0.580211
C 3.989266 -1.198804 1.348356
C -2.970101 -1.255393 -0.678837
C -4.293622 2.482381 0.966378
C -4.994725 1.310103 1.246248
C 6.198054 -0.408404 -0.204978
C 5.294779 -1.544546 1.751469
C -5.277546 -1.156634 0.969577
C -3.691303 -2.419503 -0.400381
C 6.409162 -1.165210 0.970785
C -4.855824 -2.372803 0.429487
H -0.591304 0.836671 1.120798
H 0.610035 1.926659 0.340315
H 1.174277 1.474756 -2.135891
H 0.326363 0.093481 -2.924036
H 1.782617 0.312589 1.765171
H 0.941545 -1.077502 0.985658
H 1.503133 -1.525978 -1.476481
H 2.697474 -0.458983 -2.290012
H -1.786061 0.889593 -2.374458
H -1.186670 2.347478 -1.530570
H -2.604516 3.373972 -0.095203
H 3.136979 -1.536732 1.945858
H -2.053509 -1.296340 -1.273944
H -4.624024 3.439662 1.384067
H -5.885735 1.331103 1.885321
H -6.166989 -1.111291 1.609856
H 7.043321 -0.071998 -0.813154
H 5.438115 -2.126957 2.668316
H -3.361698 -3.379586 -0.813397
H 7.426394 -1.436832 1.269452
H -5.410744 -3.293725 0.640809


