%chk=000118488.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000118488

0 1
Cl -2.117958 1.094476 1.517987
O -8.271045 0.551524 -0.019296
C 7.049134 0.439028 -0.027557
C 6.152644 -0.806531 -0.043667
C 8.534234 0.062318 -0.115396
C 4.669319 -0.426805 0.044501
C 9.430111 1.308010 -0.098826
C 3.768407 -1.672351 0.028509
C 10.916303 0.933243 -0.186810
C 2.319048 -1.280748 0.115471
C 11.812513 2.169618 -0.170869
C 1.578738 -1.040312 -1.052669
C 1.696847 -1.140976 1.366538
C 0.234985 -0.673158 -0.973118
C 0.354614 -0.770995 1.450112
C -0.387374 -0.541227 0.279446
C -1.804343 -0.164521 0.363544
C -2.804351 -0.708100 -0.342051
C -4.215852 -0.318274 -0.255287
C -5.193754 -1.321707 -0.082645
C -4.612033 1.022192 -0.359199
C -6.913582 0.365936 -0.109122
C -6.539149 -0.992210 -0.004626
C -5.963051 1.377728 -0.290635
C -8.789496 1.919313 -0.092475
C -10.285831 1.727588 0.056629
H 6.863666 1.024938 0.893495
H 6.780440 1.107726 -0.868146
H 6.422493 -1.474422 0.797138
H 6.339087 -1.391686 -0.964863
H 8.803561 -0.605737 0.725325
H 8.720476 -0.522620 -1.036679
H 4.479778 0.158304 0.965866
H 4.396283 0.241481 -0.795645
H 9.245559 1.894168 0.821903
H 9.162307 1.977532 -0.938683
H 3.956925 -2.263875 -0.890428
H 4.039448 -2.345981 0.866899
H 11.186416 0.265413 0.654516
H 11.103044 0.348544 -1.108773
H 12.870706 1.892578 -0.234069
H 11.680286 2.752221 0.747923
H 11.596809 2.835506 -1.014151
H 2.055021 -1.136264 -2.026894
H 2.265199 -1.318079 2.278249
H -0.330688 -0.481327 -1.884338
H -0.120340 -0.661043 2.426142
H -2.594009 -1.527728 -1.039545
H -4.887241 -2.364854 -0.000905
H -3.863538 1.802798 -0.504213
H -7.308254 -1.747837 0.135836
H -6.247514 2.420249 -0.374395
H -8.507159 2.346177 -1.069888
H -8.347857 2.503940 0.732593
H -10.685711 1.082032 -0.738130
H -10.531010 1.236265 1.009001
H -10.817860 2.684522 0.019468


%chk=000118488-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000118488

0 1
Cl -2.166777 1.322167 2.233079
O -8.454447 0.458991 -0.782162
C 7.224074 0.409341 -0.088380
C 6.235224 -0.768999 0.058658
C 8.696365 -0.045858 -0.205643
C 4.761638 -0.322832 0.179833
C 9.693543 1.124529 -0.359263
C 3.784818 -1.524683 0.322584
C 11.163884 0.661996 -0.476684
C 2.332400 -1.098164 0.457362
C 12.155958 1.834358 -0.635032
C 1.481995 -1.008471 -0.675090
C 1.792115 -0.728348 1.716267
C 0.146907 -0.576019 -0.556584
C 0.457309 -0.299080 1.846239
C -0.400768 -0.227755 0.713463
C -1.822351 0.168417 0.825654
C -2.831270 -0.259787 0.004304
C -4.268025 0.013813 -0.108120
C -4.990041 -0.741054 -1.088651
C -5.012366 0.958756 0.656529
C -7.083872 0.367990 -0.512192
C -6.366259 -0.575253 -1.291785
C -6.396805 1.137430 0.461387
C -9.253700 1.417107 0.010358
C -10.696144 1.292341 -0.471736
H 7.118580 1.089054 0.782950
H 6.952369 1.007704 -0.982996
H 6.510601 -1.368913 0.951704
H 6.341746 -1.447271 -0.814233
H 8.967351 -0.641951 0.691115
H 8.798876 -0.729784 -1.074477
H 4.644139 0.347152 1.055480
H 4.475564 0.274684 -0.709237
H 9.594733 1.809581 0.508998
H 9.425615 1.721121 -1.256514
H 3.905568 -2.183924 -0.559592
H 4.087617 -2.117942 1.208526
H 11.431106 0.068117 0.421379
H 11.260552 -0.024887 -1.342447
H 13.198501 1.475817 -0.718981
H 12.103196 2.519073 0.232687
H 11.927970 2.426302 -1.541679
H 1.876258 -1.270338 -1.664866
H 2.426377 -0.786686 2.609672
H -0.469305 -0.482139 -1.457451
H 0.065560 -0.027298 2.831255
H -2.478597 -1.001649 -0.728630
H -4.449488 -1.475733 -1.698511
H -4.507710 1.563604 1.411598
H -6.908034 -1.159708 -2.041371
H -6.925648 1.875496 1.071763
H -8.861280 2.442412 -0.148497
H -9.164838 1.166197 1.087272
H -10.770187 1.532214 -1.546103
H -11.069760 0.265589 -0.318942
H -11.345435 1.989177 0.088833


