%chk=000231338.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231338

0 1
Cl -3.998024 0.718004 2.721033
Cl -5.635872 -2.387656 -1.177764
Cl 7.013224 -1.787328 0.161477
O 0.451708 -0.250187 0.902337
N 1.886636 1.171356 -0.200565
N -3.490748 -0.879607 -1.423615
N -4.692246 -0.787895 0.686043
C -0.489216 1.810192 0.006526
C -0.876811 1.767001 -1.481439
C -1.703475 1.538307 0.915925
C -1.469646 0.410378 -1.870199
C -2.684621 0.554992 0.362354
C -2.583453 0.019503 -0.945922
C 0.619819 0.785916 0.296182
C -3.775801 0.108403 1.133139
C 3.099927 0.418698 -0.088190
C -4.502287 -1.252153 -0.585979
C 4.260425 0.977328 -0.668582
C 3.160442 -0.824490 0.568278
C 5.471917 0.292079 -0.589744
C 4.374590 -1.506111 0.644164
C 5.514314 -0.941519 0.065506
H -0.107820 2.834165 0.252868
H -0.005907 1.992601 -2.125680
H -1.617379 2.569775 -1.683133
H -2.230441 2.496243 1.122993
H -1.342374 1.169874 1.908279
H -0.691233 -0.389012 -1.842747
H -1.824500 0.424442 -2.925563
H 1.969350 2.056789 -0.703326
H 4.223724 1.938008 -1.177178
H 2.260979 -1.260502 1.020679
H 6.374660 0.713544 -1.033771
H 4.431339 -2.471138 1.151313


%chk=000231338-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231338

0 1
Cl -3.963101 0.805384 2.851303
Cl -5.645414 -2.559286 -0.985719
Cl 7.153886 -1.840439 0.142032
O 0.304852 -0.369638 0.696906
N 1.892368 1.156573 -0.120826
N -3.521175 -0.937256 -1.345722
N -4.632002 -0.810035 0.793997
C -0.473913 1.835826 -0.081928
C -0.900200 1.764097 -1.580564
C -1.704200 1.655602 0.840066
C -1.545945 0.404781 -1.917953
C -2.679684 0.597149 0.368513
C -2.622630 0.014689 -0.930852
C 0.596367 0.766806 0.217963
C -3.744782 0.122510 1.172270
C 3.101790 0.406175 -0.037652
C -4.463947 -1.295614 -0.457193
C 4.297883 1.044124 -0.463948
C 3.152442 -0.928117 0.448078
C 5.532326 0.367163 -0.411333
C 4.389291 -1.605804 0.500261
C 5.561639 -0.955749 0.071775
H -0.040945 2.838124 0.111067
H -0.031597 1.936331 -2.242916
H -1.622886 2.580656 -1.773011
H -2.241382 2.622046 0.915844
H -1.375657 1.405048 1.864576
H -0.783049 -0.398618 -1.914888
H -1.984707 0.411490 -2.931031
H 1.994935 2.110326 -0.476961
H 4.271558 2.074725 -0.840034
H 2.235050 -1.416735 0.779570
H 6.451220 0.860350 -0.740142
H 4.432808 -2.632682 0.874153


