%chk=000054468.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054468

0 1
 Cl  -6.203800      -1.979100     -0.5598000    
 O    2.354400      -1.610300      0.7398000    
 N    3.804000      0.1951000      0.9417000    
 N   0.2175000     -1.2900000E-02  0.3859000    
 N   -3.320000       2.177300     -0.1653000    
 C    5.735600     -0.8842000     -0.1537000    
 C    5.020400     -0.5562000       1.152600    
 C    6.160400      0.3691000     -0.9224000    
 C  -0.9900000      0.7007000      0.1989000    
 C    1.476800      0.6347000      0.5678000    
 C   -2.215100      4.3800000E-02  2.0800000E-02
 C    2.564800     -0.4002000      0.7517000    
 C   -3.371000      0.8318000     -0.1604000    
 C    6.923000      1.2100000E-02  -2.188700    
 C  -0.9344000       2.087000      0.1943000    
 C   -2.304900      -1.358600      2.0500001E-02
 C   -4.587600      0.1786000     -0.3373000    
 C   -2.117900       2.772500      9.8999999E-03
 C   -3.534700      -1.985400     -0.1586000    
 C   -4.677300      -1.215600     -0.3376000    
 H    5.081600      -1.494500     -0.7888000    
 H    6.620500      -1.491100      7.3200002E-02
 H    5.665000      4.4300001E-02   1.803100    
 H    4.777200      -1.483900       1.682000    
 H    6.794500      0.9980000     -0.2867000    
 H    5.282100      0.9644000      -1.196300    
 H    1.739700       1.239700     -0.3083000    
 H    1.469300       1.268400       1.462700    
 H    3.872600       1.208700      0.9312000    
 H   0.1946000      -1.023300      0.3933000    
 H    6.305600     -0.5924000      -2.861000    
 H    7.217300      0.9208000      -2.722900    
 H    7.830800     -0.5529000      -1.954200    
 H  -2.2900000E-02   2.657500      0.3253000    
 H   -1.444400      -2.005600      0.1559000    
 H   -5.489800      0.7728000     -0.4785000    
 H   -2.136600       3.857400     -3.4000000E-03
 H   -3.585900      -3.070900     -0.1561000    


%chk=000054468-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054468

0 1
Cl -6.255171 -2.233978 -0.526035
O 2.246071 -1.474481 0.744985
N 3.829232 0.228626 0.908976
N 0.188899 0.168443 0.408320
N -3.549125 2.180995 -0.152401
C 5.736108 -0.958480 -0.254715
C 4.987500 -0.676363 1.068440
C 6.388450 0.289662 -0.891440
C -1.015111 0.813537 0.227907
C 1.459449 0.846227 0.585674
C -2.243731 0.051104 0.052334
C 2.547424 -0.239488 0.750159
C -3.475508 0.790681 -0.133057
C 7.170059 -0.044773 -2.180373
C -1.115144 2.224611 0.203564
C -2.291094 -1.378139 0.053212
C -4.703175 0.072537 -0.309374
C -2.382679 2.839299 0.014260
C -3.495968 -2.067167 -0.120117
C -4.691566 -1.317502 -0.300023
H 5.033153 -1.425053 -0.971647
H 6.521018 -1.713222 -0.044143
H 5.676783 -0.227677 1.809279
H 4.596406 -1.619992 1.485730
H 7.071871 0.763212 -0.156062
H 5.605796 1.039685 -1.127807
H 1.706652 1.490603 -0.286595
H 1.453862 1.502683 1.483647
H 3.996313 1.235924 0.874085
H 0.267206 -0.854166 0.440869
H 6.505901 -0.499942 -2.938561
H 7.622209 0.859986 -2.625632
H 7.985001 -0.763633 -1.974249
H -0.233333 2.858687 0.329784
H -1.380786 -1.973073 0.189238
H -5.618303 0.653544 -0.447160
H -2.447348 3.934699 -0.001460
H -3.525920 -3.160019 -0.119010


