%chk=000058612.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058612

0 1
 Cl -0.1790000       3.446400     -4.8500001E-02
 O   0.9579000      0.8379000      0.8982000    
 O  -0.4477000      -1.527200       1.118100    
 O   -5.014000      -1.607400     -5.6000002E-02
 N    4.294000      0.3738000     -0.5988000    
 N   -4.424400      0.6387000     -0.4633000    
 C    3.297600      0.6710000      0.4297000    
 C    5.592000      0.9384000     -0.2312000    
 C    4.403700      -1.070200     -0.8019000    
 C    1.891300      0.5585000     -0.1370000    
 C    6.115800      0.3197000       1.053800    
 C    5.390500      -1.395300      -1.910400    
 C  -0.3696000      0.8011000      0.5597000    
 C   -1.070400     -0.3995000      0.6745000    
 C   -1.020300       1.947600      0.1039000    
 C   -3.072500      0.6930000     -0.1222000    
 C   -2.421900     -0.4536000      0.3335000    
 C   -2.371700       1.893700     -0.2371000    
 C  -0.4231000      -2.644800      0.2325000    
 C   0.8357000      -3.446700      0.4854000    
 C   -5.285200     -0.4659000     -0.4144000    
 C   -6.678500     -0.1094000     -0.8684000    
 H    3.410900       1.699100      0.8004000    
 H    3.384300      2.2500001E-02   1.311200    
 H    5.489200       2.022500     -9.1399997E-02
 H    6.327500      0.8388000      -1.036400    
 H    3.439000      -1.461800      -1.143200    
 H    4.644000      -1.634300      0.1064000    
 H    1.690400     -0.4449000     -0.5240000    
 H    1.760800       1.271500     -0.9605000    
 H    7.048200      0.8282000       1.328200    
 H    6.372900     -0.7383000      0.9533000    
 H    5.444200      0.4449000       1.907600    
 H    5.281300      -2.446200      -2.201300    
 H    6.431100      -1.263100      -1.599600    
 H    5.208300     -0.7906000      -2.805600    
 H   -2.914700      -1.407700      0.4553000    
 H   -2.880700       2.787100     -0.5929000    
 H   -4.826300       1.516100     -0.7872000    
 H  -0.4371000      -2.318200     -0.8149000    
 H   -1.304600      -3.267300      0.4202000    
 H    1.726700      -2.831300      0.3267000    
 H   0.8700000      -3.791300       1.524200    
 H   0.8848000      -4.316200     -0.1760000    
 H   -7.315300     -0.9981000     -0.8434000    
 H   -7.100600      0.6495000     -0.2038000    
 H   -6.648300      0.2760000      -1.891400    


%chk=000058612-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058612

0 1
Cl -0.281290 3.433920 1.131904
O 1.040033 0.752466 0.899703
O -0.189687 -1.642489 0.107482
O -5.000502 -1.472132 -0.813945
N 4.493484 0.162982 -0.403257
N -4.518533 0.756023 -0.243373
C 3.413059 0.714356 0.449969
C 5.609499 1.105548 -0.663237
C 4.891573 -1.212943 -0.014340
C 2.044719 0.297455 -0.107322
C 6.506189 1.461793 0.554982
C 5.681211 -1.952580 -1.110369
C -0.307364 0.708941 0.543923
C -0.987904 -0.493605 0.164549
C -1.090946 1.880180 0.649392
C -3.116176 0.699519 0.011233
C -2.372496 -0.500649 -0.110731
C -2.474389 1.900324 0.400446
C -0.852414 -2.926801 -0.220224
C 0.226452 -4.004190 -0.170337
C -5.376413 -0.274700 -0.628890
C -6.832909 0.144934 -0.815589
H 3.472451 1.817432 0.461644
H 3.482434 0.378870 1.510315
H 5.166828 2.034064 -1.071676
H 6.238876 0.684742 -1.469328
H 3.961220 -1.776329 0.190466
H 5.476853 -1.226629 0.939929
H 1.966323 -0.795351 -0.234531
H 1.847822 0.795084 -1.075635
H 7.276046 2.198784 0.258861
H 7.027774 0.572346 0.953023
H 5.910297 1.904634 1.374262
H 5.856782 -3.002387 -0.810881
H 6.668242 -1.491490 -1.294926
H 5.115150 -1.945640 -2.058738
H -2.901196 -1.407738 -0.403645
H -3.031313 2.837503 0.501384
H -4.944316 1.677516 -0.125321
H -1.309720 -2.855770 -1.227213
H -1.654656 -3.119800 0.519450
H 1.020667 -3.800973 -0.909339
H 0.684770 -4.052433 0.832163
H -0.218046 -4.989670 -0.399511
H -7.144478 -0.090844 -1.847787
H -7.467244 -0.453375 -0.139044
H -7.020560 1.215807 -0.623891


