%chk=000118368.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000118368

0 1
Cl 4.673930 1.002682 0.394587
O -1.845987 -0.124136 0.816420
O -1.482381 -1.561873 -0.891228
N 2.311320 2.517901 1.464082
N 3.721513 -1.510050 -0.946423
C -3.992652 0.583670 -0.092465
C -3.276792 -0.431767 0.816068
C -4.188093 0.017310 -1.500236
C -5.333274 0.986662 0.529834
C 0.373900 -0.291313 0.043349
C -1.044509 -0.751234 -0.106394
C 1.364175 -1.075963 -0.545831
C 0.669417 0.879630 0.735987
C 2.017949 1.297595 0.845391
C 2.718643 -0.681211 -0.433725
C 3.033185 0.508797 0.260549
H -3.339656 1.492776 -0.159975
H -3.518937 -0.308233 1.886132
H -3.429035 -1.479642 0.506228
H -3.248859 -0.398174 -1.896571
H -4.530562 0.787373 -2.198415
H -4.923828 -0.794073 -1.518864
H -5.865920 1.695320 -0.115828
H -5.200695 1.471103 1.503108
H -5.994000 0.124084 0.670955
H 1.091726 -1.984414 -1.081663
H -0.132666 1.465101 1.182710
H 1.612323 2.914288 2.073268
H 3.259570 2.703243 1.755597
H 4.647085 -1.132996 -1.085180
H 3.455112 -2.204256 -1.627765


%chk=000118368-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000118368

0 1
Cl 4.803593 0.966286 0.066099
O -1.896574 0.098632 0.844688
O -1.452080 -1.902295 -0.281171
N 2.496723 2.502203 1.326118
N 3.640066 -1.599268 -1.096912
C -4.170261 0.722667 0.053024
C -3.344452 -0.241370 0.925940
C -3.826278 0.570529 -1.445167
C -5.675243 0.474110 0.318720
C 0.369038 -0.345153 0.191342
C -1.047617 -0.817079 0.207236
C 1.318916 -1.181579 -0.436626
C 0.740749 0.883758 0.781405
C 2.101176 1.300267 0.751702
C 2.686572 -0.795004 -0.485696
C 3.037358 0.443400 0.114777
H -3.923608 1.756887 0.369275
H -3.603910 -0.131826 1.993731
H -3.482446 -1.290790 0.606416
H -2.757349 0.773762 -1.633157
H -4.419180 1.276569 -2.055098
H -4.044328 -0.455616 -1.796001
H -6.292868 1.172855 -0.273789
H -5.932231 0.615538 1.385587
H -5.963932 -0.555108 0.031175
H 0.987835 -2.125714 -0.880382
H -0.017068 1.507920 1.261244
H 1.814169 3.100103 1.780431
H 3.471568 2.788816 1.301621
H 4.615196 -1.313806 -1.124124
H 3.368465 -2.481494 -1.518707


