%chk=000049954.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049954

0 1
 Cl   1.136500       1.930400      -1.362900    
 Cl   1.205600      -3.238600      0.3970000    
 O   -3.069800     -0.5390000      2.0900000E-02
 O    3.240800      3.7300002E-02   1.450600    
 N    5.727400      0.4134000      0.3156000    
 N    2.441800     -0.6885000     -0.6342000    
 C    4.802900     -0.5414000     -0.2947000    
 C    7.081300      0.2153000     -0.2006000    
 C    5.282100       1.784600      6.9899999E-02
 C    3.418600     -0.3566000      0.3024000    
 C    7.584000      -1.186400      0.1002000    
 C    6.231700       2.790900      0.6975000    
 C    1.036900     -0.6504000     -0.4672000    
 C   0.3431000      0.5113000     -0.7759000    
 C   0.3737000      -1.775500      2.7999999E-03
 C   -1.718600     -0.5756000     -0.1395000    
 C   -1.041500      0.5489000     -0.6111000    
 C   -1.011000      -1.737800      0.1676000    
 C   -3.730300      0.6809000     -0.3122000    
 C   -5.198400      0.5331000     -3.9700001E-02
 C   -6.041000      6.5399997E-02  -1.042000    
 C   -5.703100      0.8648000       1.212900    
 C   -7.405700     -7.2200000E-02 -0.7888000    
 C   -7.067900      0.7270000       1.466000    
 C   -7.919200      0.2585000      0.4652000    
 H    4.775000     -0.4266000      -1.385600    
 H    5.065800      -1.578900     -6.2600002E-02
 H    7.142200      0.4080000      -1.279200    
 H    7.790700      0.8856000      0.2949000    
 H    5.196300       1.992900      -1.004700    
 H    4.299000       1.980000      0.5088000    
 H    7.420900      -1.460200       1.148300    
 H    7.122300      -1.943300     -0.5411000    
 H    8.662900      -1.237100     -8.5800000E-02
 H    6.469500       2.534700       1.735700    
 H    7.162100       2.901400      0.1321000    
 H    5.759300       3.780000      0.7082000    
 H    2.743800      -1.213000      -1.452800    
 H   -1.541100       1.477300     -0.8676000    
 H   -1.548900      -2.608800      0.5348000    
 H   -3.350200       1.511600      0.2973000    
 H   -3.593200      0.9204000      -1.375100    
 H   -5.651800     -0.1977000      -2.021700    
 H   -5.049200       1.228100       2.000900    
 H   -8.068500     -0.4376000      -1.567700    
 H   -7.467700      0.9837000       2.442600    
 H   -8.981800      0.1510000      0.6626000    


%chk=000049954-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000049954

0 1
Cl 1.374096 2.229334 -0.673788
Cl 1.044200 -3.335193 -1.002762
O -3.132152 -0.429379 -0.255121
O 3.063960 0.219545 1.221999
N 5.821569 0.416340 0.103543
N 2.507772 -0.662400 -0.873174
C 4.879589 -0.661910 -0.218049
C 7.233596 -0.039489 0.139821
C 5.598677 1.634407 -0.720036
C 3.420354 -0.303336 0.137560
C 7.544977 -0.968617 1.329242
C 6.181562 2.910000 -0.083686
C 1.096781 -0.555530 -0.738087
C 0.429364 0.683737 -0.582599
C 0.259919 -1.706306 -0.764879
C -1.745633 -0.392422 -0.417487
C -0.962734 0.788634 -0.402019
C -1.129736 -1.654212 -0.620477
C -3.828026 0.866994 -0.003901
C -5.292383 0.569272 0.204906
C -6.216660 0.723522 -0.857534
C -5.758162 0.122078 1.467116
C -7.586470 0.435394 -0.664114
C -7.125600 -0.169694 1.662926
C -8.042944 -0.012111 0.597142
H 4.934111 -0.977026 -1.297699
H 5.137791 -1.551442 0.385851
H 7.530597 -0.539892 -0.819844
H 7.865821 0.860975 0.230997
H 6.003406 1.505364 -1.758094
H 4.506053 1.771154 -0.818280
H 7.238407 -0.485743 2.272892
H 7.024698 -1.941232 1.257557
H 8.629436 -1.180091 1.372708
H 5.774164 3.036568 0.933743
H 7.284247 2.885668 -0.016406
H 5.906766 3.794172 -0.688350
H 2.870871 -1.190695 -1.670907
H -1.407972 1.777047 -0.274676
H -1.744991 -2.556130 -0.642451
H -3.376085 1.335928 0.893028
H -3.671452 1.529778 -0.877823
H -5.862649 1.064299 -1.838125
H -5.047160 -0.003843 2.292366
H -8.293592 0.558831 -1.491627
H -7.476235 -0.515705 2.641391
H -9.104847 -0.235345 0.749305


