%chk=000183525.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183525

0 1
Cl -0.900478 0.294372 2.196381
S 0.611795 0.151855 -1.824014
O 3.448496 1.182392 0.401429
O -0.825260 2.751386 0.517806
N 1.926537 -0.121699 -0.778734
N 1.344063 2.068088 0.095287
N -0.559759 0.834717 -0.766787
C 2.425051 -1.495383 -0.380577
C 2.218633 -1.672437 1.131776
C 1.634833 -2.557711 -1.153694
C 3.915400 -1.563794 -0.741987
C 2.338321 1.038022 -0.066962
C -0.082909 1.946989 0.005141
C -1.710936 0.079135 -0.378342
C 1.847962 3.398370 0.547685
C -1.980796 -0.234303 0.969200
C -2.594842 -0.370871 -1.375821
C -3.114811 -0.965326 1.325788
C -3.721247 -1.113841 -1.017051
C -3.984125 -1.409165 0.325530
H 1.172259 -1.531393 1.427713
H 2.515494 -2.675711 1.456065
H 2.823764 -0.961797 1.712135
H 1.734936 -2.449108 -2.240231
H 0.565183 -2.548669 -0.910425
H 2.004952 -3.560850 -0.904861
H 4.489870 -0.774429 -0.228965
H 4.350623 -2.525162 -0.453833
H 4.083958 -1.424904 -1.815430
H 2.797791 3.282260 1.102373
H 1.111784 3.883025 1.215796
H 2.022398 4.051525 -0.322844
H -2.406897 -0.127699 -2.422174
H -3.315525 -1.185876 2.375331
H -4.406168 -1.459257 -1.792224
H -4.870648 -1.982654 0.594321


%chk=000183525-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183525

0 1
Cl -0.983147 -0.268956 2.305835
S 0.583840 -0.114201 -1.789945
O 3.349073 1.164931 0.642768
O -0.904231 2.668769 0.518281
N 1.938129 -0.235739 -0.606875
N 1.285443 2.024942 -0.079527
N -0.590639 0.660000 -0.646939
C 2.651730 -1.540123 -0.270969
C 2.639800 -1.749543 1.266297
C 1.911957 -2.714040 -0.950869
C 4.104223 -1.454619 -0.811689
C 2.270873 0.974588 0.010781
C -0.131844 1.842351 -0.032156
C -1.856509 0.067624 -0.347304
C 1.761142 3.367700 0.344165
C -2.188003 -0.402240 0.950712
C -2.818094 -0.085967 -1.377812
C -3.439633 -0.983386 1.226708
C -4.065531 -0.691465 -1.122792
C -4.380097 -1.133450 0.182677
H 1.603789 -1.786767 1.646394
H 3.135401 -2.708332 1.503512
H 3.182492 -0.941742 1.781968
H 1.905092 -2.618008 -2.052078
H 0.869172 -2.801220 -0.600651
H 2.442476 -3.648422 -0.697250
H 4.639972 -0.613461 -0.344895
H 4.641026 -2.392976 -0.580550
H 4.105003 -1.314042 -1.907850
H 2.771310 3.525997 -0.060226
H 1.799442 3.449280 1.443734
H 1.063867 4.123013 -0.046411
H -2.574490 0.295758 -2.375018
H -3.668390 -1.323476 2.240835
H -4.793674 -0.800576 -1.932751
H -5.351272 -1.592107 0.394688


