%chk=000001547.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001547

0 1
 Cl  -1.423500      -3.903500     -0.3890000    
 O    3.299000       1.233800     -0.7707000    
 O    2.929300      -2.217700      0.1038000    
 O    5.248600     -0.7258000       1.517100    
 O    6.820300       1.425900      0.1642000    
 N    1.107100      0.4333000     -0.3754000    
 N   -3.425100      0.5856000      0.4827000    
 N  -0.6380000       1.739600      9.6100003E-02
 N   6.8000001E-03  -1.732200     -0.4136000    
 N   -2.379600      -1.523200      5.3199999E-02
 C    2.485400      4.8599999E-02 -0.6730000    
 C    3.115700     -0.8427000      0.3910000    
 C    4.572900     -0.4415000      0.3069000    
 C    4.462900       1.053800      5.4600000E-02
 C   -4.738900      5.1000002E-03  0.6614000    
 C   -5.671600      0.9865000       1.360400    
 C   -5.422300     -0.2068000     -0.6840000    
 C   -6.146000       1.929300      0.2569000    
 C   -5.992000       1.160600      -1.055300    
 C    5.676200       1.637300     -0.6470000    
 C   2.8400000E-02 -0.3988000     -0.2682000    
 C   -1.042800      0.4303000      2.3700001E-02
 C   -2.283300     -0.1783000      0.1858000    
 C   0.6555000       1.706900     -0.1475000    
 C   -1.245200      -2.206500     -0.2341000    
 H    2.461400     -0.4267000      -1.661100    
 H    2.711300     -0.6507000       1.392100    
 H    5.078200     -0.9705000     -0.5101000    
 H    4.301300       1.585900       1.001200    
 H   -4.671900     -0.9240000       1.238500    
 H   -5.195400       1.529500       2.183200    
 H   -6.535500      0.4478000       1.769100    
 H   -6.248600     -0.9188000     -0.5663000    
 H   -4.759800     -0.5945000      -1.464200    
 H   -5.527000       2.833700      0.2331000    
 H   -7.180500       2.246700      0.4233000    
 H   -6.945600       1.063100      -1.584100    
 H   -5.302500       1.694400      -1.719600    
 H    5.543700       2.711600     -0.8138000    
 H    5.832700       1.167500      -1.624200    
 H   -3.311800       1.592300      0.5313000    
 H    1.299100       2.575800     -0.1669000    
 H    3.286600      -2.395000     -0.7828000    
 H    6.148700     -0.3662000       1.440400    
 H    7.579300       1.809900     -0.3070000    


%chk=000001547-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001547

0 1
Cl -1.704430 -3.673693 -1.971375
O 3.116638 0.591135 -1.029220
O 3.417016 -1.844963 1.730149
O 5.691230 0.397444 1.608512
O 6.664774 1.579416 -0.797302
N 1.139319 0.031572 0.243678
N -3.527209 0.311038 0.547264
N -0.617954 1.276057 1.040318
N -0.131469 -1.798055 -0.858394
N -2.554023 -1.512413 -0.618156
C 2.491698 -0.388092 -0.099703
C 3.456537 -0.527567 1.124770
C 4.810607 -0.060949 0.554840
C 4.380318 1.067745 -0.410191
C -4.915141 -0.142996 0.299632
C -5.891092 0.653904 1.197755
C -5.399478 0.218611 -1.131249
C -6.120168 2.006740 0.452209
C -5.777569 1.726450 -1.053434
C 5.395209 1.340868 -1.518890
C -0.027474 -0.636822 -0.147691
C -1.096883 0.140943 0.358624
C -2.418664 -0.341562 0.099639
C 0.719603 1.175434 0.950028
C -1.428954 -2.135978 -1.031352
H 2.379343 -1.348840 -0.635928
H 3.165116 0.153379 1.942116
H 5.272200 -0.886136 -0.037950
H 4.199690 1.991680 0.178117
H -4.948234 -1.232124 0.473272
H -5.518171 0.779717 2.230796
H -6.838171 0.088088 1.260250
H -6.289495 -0.398176 -1.360530
H -4.635838 -0.009730 -1.892398
H -5.464332 2.799502 0.858451
H -7.157900 2.360491 0.582129
H -6.624339 1.964623 -1.720639
H -4.926558 2.352733 -1.376694
H 5.102827 2.225222 -2.116932
H 5.471939 0.455729 -2.181545
H -3.368000 1.174202 1.072682
H 1.422406 1.900046 1.353819
H 3.816620 -2.512663 1.115282
H 6.457186 0.843102 1.152286
H 7.374768 1.856286 -1.424944


