%chk=000002051.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002051

0 1
 Cl   5.386700     -0.6973000       2.174000    
 O   -3.317400       2.338700      3.1700000E-02
 O   -4.961400      0.1517000      0.5175000    
 N    1.302400      0.3786000     -0.7394000    
 N   -1.253300      -2.791700      3.0000001E-04
 N   0.9428000      -1.934000     -0.4978000    
 C  -0.9295000     -0.4272000     -0.2383000    
 C   -1.748700      -1.541600      6.0999999E-03
 C   0.4142000     -0.6958000     -0.4845000    
 C   -1.458500      0.8751000     -0.2297000    
 C   -2.812000       1.074800      2.3499999E-02
 C   -3.099500      -1.312700      0.2567000    
 C   -3.633200     -2.0500001E-02  0.2670000    
 C    2.673800      0.5521000     -0.4948000    
 C   6.5099999E-02  -2.920000     -0.2516000    
 C    3.281200     -8.3800003E-02  0.5923000    
 C    3.442400       1.361500      -1.337000    
 C    4.643900      8.7800004E-02  0.8348000    
 C    4.805300       1.533200      -1.094400    
 C    5.406000      0.8964000     -8.5000005E-03
 C   -3.311100       3.032300       1.278500    
 C   -5.839200      0.1421000     -0.6064000    
 H  -0.8365000       1.748200     -0.4097000    
 H   -3.757700      -2.158500      0.4504000    
 H   0.9231000       1.057000      -1.394300    
 H   0.4581000      -3.929300     -0.2545000    
 H    2.694200     -0.7056000       1.264700    
 H    2.988200       1.863500      -2.187800    
 H    5.398600       2.162500      -1.751200    
 H    6.469000       1.039300      0.1682000    
 H   -3.910400       2.495800       2.020900    
 H   -3.750800       4.021100       1.122400    
 H   -2.286300       3.157900       1.641900    
 H   -5.586900      0.9507000      -1.299600    
 H   -6.859600      0.2968000     -0.2454000    
 H   -5.792500     -0.8227000      -1.121200    


%chk=000002051-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000002051

0 1
Cl 6.157871 -1.938931 0.084717
O -3.396418 2.352972 -0.278026
O -5.093272 0.054032 0.324377
N 1.445486 0.423764 -0.240525
N -1.162412 -2.730791 0.776412
N 1.078332 -1.839064 0.383079
C -0.852637 -0.340242 0.155031
C -1.690096 -1.467200 0.498607
C 0.582375 -0.607522 0.103841
C -1.465349 0.925099 -0.084060
C -2.853521 1.078389 -0.015754
C -3.105712 -1.300556 0.537756
C -3.690387 -0.063556 0.263296
C 2.860331 0.456946 -0.352515
C 0.174645 -2.830043 0.705180
C 3.697401 -0.663456 -0.098532
C 3.441646 1.697882 -0.741290
C 5.084841 -0.497852 -0.242008
C 4.837704 1.818513 -0.873237
C 5.687975 0.715605 -0.623598
C -4.154755 2.958759 0.846523
C -5.747309 0.417669 -0.957848
H -0.894552 1.834383 -0.306169
H -3.732143 -2.165346 0.770701
H 0.994196 1.312146 -0.462049
H 0.614274 -3.808493 0.923074
H 3.246238 -1.611871 0.194546
H 2.799586 2.565722 -0.939471
H 5.273816 2.777245 -1.172358
H 6.773152 0.798895 -0.723488
H -4.980268 2.299776 1.167678
H -4.544965 3.909124 0.453168
H -3.474093 3.151635 1.696760
H -5.350943 1.371446 -1.349879
H -6.817460 0.510151 -0.720598
H -5.593077 -0.388825 -1.698541


