%chk=000257078.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257078

0 1
Cl 5.350840 -1.521056 0.248411
O 1.656262 1.200309 0.530100
N 0.740501 -0.434934 -0.837715
N 3.035663 0.194267 -1.037272
C -0.681381 -0.239414 -0.383853
C -3.022697 -1.113311 -0.674940
C -2.238945 -0.318899 1.587126
C -2.630283 1.345481 -0.268945
C -1.555623 -1.279462 -1.132947
C -0.770961 -0.478045 1.141955
C -1.163705 1.192696 -0.721447
C -3.118665 -1.350560 0.847355
C -3.509552 0.313207 -1.008576
C -2.726378 1.108032 1.253883
C 1.782623 0.372799 -0.363681
C 4.209341 0.847800 -0.410980
C 4.756658 0.082303 0.791850
H -3.655976 -1.857092 -1.208253
H -2.309209 -0.488898 2.684646
H -2.982462 2.373688 -0.507976
H -1.486685 -1.141300 -2.225447
H -1.208357 -2.305625 -0.919261
H -0.123089 0.249228 1.674201
H -0.387477 -1.477854 1.404296
H -0.520864 1.934524 -0.204212
H -1.064480 1.399202 -1.799172
H -2.796936 -2.376213 1.097310
H -4.167490 -1.266278 1.180763
H -3.470867 0.487881 -2.097423
H -4.566726 0.433113 -0.714518
H -2.115034 1.853476 1.793640
H -3.764400 1.249427 1.599460
H 0.873949 -0.977964 -1.687085
H 3.245605 -0.729609 -1.422444
H 4.988830 0.961437 -1.199658
H 3.914669 1.878977 -0.084738
H 3.977484 -0.089669 1.561881
H 5.602619 0.611837 1.266967


%chk=000257078-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257078

0 1
Cl 5.891699 -1.409395 -0.766240
O 1.626916 1.379737 0.698196
N 0.733890 -0.361762 -0.608697
N 3.037033 0.091519 -0.653783
C -0.698847 -0.181785 -0.252564
C -3.009684 -1.154078 -0.699452
C -2.450840 -0.227139 1.592400
C -2.731568 1.346477 -0.377561
C -1.495537 -1.278598 -1.014386
C -0.935899 -0.360101 1.277269
C -1.217581 1.218886 -0.695565
C -3.236371 -1.326626 0.827623
C -3.516468 0.246027 -1.142217
C -2.953010 1.174488 1.150289
C 1.774812 0.426991 -0.135509
C 4.235702 0.814351 -0.239288
C 5.264561 -0.079414 0.450264
H -3.559310 -1.942165 -1.251041
H -2.604305 -0.350271 2.682665
H -3.086156 2.346864 -0.694992
H -1.328916 -1.170363 -2.106777
H -1.128407 -2.282083 -0.713577
H -0.350742 0.401920 1.821732
H -0.564306 -1.357510 1.587303
H -0.636829 1.997573 -0.169714
H -1.041508 1.343770 -1.783056
H -2.897651 -2.331055 1.153168
H -4.318307 -1.255522 1.057746
H -3.378860 0.372528 -2.235285
H -4.601579 0.336044 -0.935625
H -2.404981 1.963003 1.702787
H -4.028611 1.287051 1.394762
H 0.943503 -1.094184 -1.289963
H 3.157754 -0.690495 -1.299554
H 4.708441 1.330857 -1.097556
H 3.895036 1.586974 0.478185
H 4.836873 -0.643243 1.291485
H 6.166852 0.474230 0.749833


