%chk=000207006.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207006

0 1
Cl 5.731530 1.352683 -1.322217
O -0.614966 0.750324 -0.017750
O -0.100262 -0.649718 1.708971
O -2.849673 4.040690 0.546486
O -0.884460 3.160014 0.391994
N -1.830007 -1.789300 -0.343518
N -2.102147 3.087538 0.393802
C 2.663568 -0.717454 0.279297
C 1.642995 0.295233 0.257411
C 3.956752 -0.393194 -0.222283
C -1.967315 0.613078 0.053138
C -2.617196 -0.663761 -0.143530
C -4.036954 -0.711460 -0.148483
C -2.725276 1.770479 0.201823
C 1.900193 1.562009 -0.233972
C 2.428591 -2.035320 0.782804
C 4.173324 0.931809 -0.715029
C 0.299503 -0.012677 0.781123
C 4.979969 -1.392518 -0.212772
C -4.789792 0.494096 0.017391
C -4.155449 1.695153 0.177799
C 3.188839 1.890583 -0.725056
C -4.653801 -1.990981 -0.337034
C 3.430537 -2.972983 0.780146
C 4.722178 -2.649349 0.275001
C -3.869809 -3.100540 -0.519021
C -2.440347 -2.954541 -0.522540
H 1.107361 2.327142 -0.246825
H 1.439028 -2.283103 1.179220
H -5.878665 0.435932 0.009167
H 5.971730 -1.148362 -0.597256
H -4.716023 2.631269 0.298035
H 3.375577 2.897469 -1.103410
H -5.742674 -2.057473 -0.332308
H 3.253551 -3.977472 1.166093
H 5.497867 -3.414326 0.284962
H -4.301288 -4.090415 -0.662747
H -1.801288 -3.833952 -0.680012


%chk=000207006-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207006

0 1
Cl 5.720824 0.680552 -2.212696
O -0.677770 0.749322 -0.155095
O -0.126298 -0.968057 1.325877
O -2.736352 3.784487 1.688597
O -0.825794 2.554412 1.895449
N -2.036862 -1.420017 -1.201901
N -2.046202 2.702963 1.514859
C 2.762202 -0.710861 0.375709
C 1.604263 -0.010218 -0.154098
C 4.058829 -0.502878 -0.257699
C -2.035620 0.601657 0.127156
C -2.758167 -0.497741 -0.462013
C -4.187550 -0.588760 -0.263129
C -2.739771 1.565942 0.863879
C 1.750087 0.850146 -1.256988
C 2.705092 -1.599843 1.501482
C 4.123438 0.387138 -1.379721
C 0.254411 -0.186127 0.435510
C 5.215457 -1.179273 0.249746
C -4.866443 0.428260 0.483852
C -4.158023 1.494114 1.026146
C 3.008537 1.054503 -1.879394
C -4.859768 -1.711043 -0.848223
C 3.851915 -2.243202 1.973383
C 5.116869 -2.035350 1.345909
C -4.125202 -2.646747 -1.577887
C -2.713149 -2.454469 -1.733051
H 0.871712 1.369178 -1.644431
H 1.740937 -1.769350 1.983986
H -5.950452 0.358887 0.624819
H 6.179057 -1.009184 -0.239036
H -4.651629 2.291442 1.587392
H 3.099480 1.725268 -2.737239
H -5.942056 -1.819446 -0.716456
H 3.778177 -2.914626 2.835707
H 6.007648 -2.546100 1.726482
H -4.605735 -3.516170 -2.036317
H -2.120392 -3.172205 -2.311665


