%chk=000276444.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276444

0 1
Cl -2.020984 -0.074783 1.116108
S 5.800744 -1.169727 0.727620
F 6.649759 -0.741358 -0.541524
O -2.857819 1.242686 -1.618699
O -0.542208 -0.194354 -1.500848
O 6.482279 -0.516572 1.807174
O 5.728303 -2.595387 0.605775
N 0.580483 1.436504 -0.308000
N -7.095485 -0.607614 1.525026
C 1.811490 0.768408 -0.080583
C 4.291533 -0.435867 0.419518
C 2.807854 1.470445 0.643564
C 2.064799 -0.538801 -0.543624
C 4.033176 0.862025 0.884848
C 3.297850 -1.127814 -0.289985
C -1.703737 1.908839 -1.085246
C -0.550206 0.902700 -1.007304
C -3.824094 0.785727 -0.729050
C -3.609609 0.141567 0.492734
C -5.135151 0.936796 -1.226973
C -5.992608 -0.201244 0.741279
C -4.682446 -0.349111 1.238061
C -6.209284 0.440043 -0.505044
H 2.624470 2.476764 1.012224
H 1.295300 -1.090897 -1.098157
H 4.802727 1.402418 1.451683
H 3.489518 -2.149297 -0.645023
H 0.503054 2.370275 0.104048
H -1.924038 2.412240 -0.129039
H -1.495500 2.666998 -1.873019
H -5.278162 1.435170 -2.187319
H -4.500577 -0.839368 2.193773
H -7.221039 0.555447 -0.890152
H -6.912864 -1.305849 2.232207
H -7.959027 -0.782009 1.030747


%chk=000276444-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276444

0 1
Cl -2.290123 2.062378 1.593723
S 6.109249 -0.669250 0.714056
F 6.392068 0.827791 1.786261
O -2.265131 -0.024837 -0.652828
O 0.334134 1.494434 -2.695809
O 6.244384 -1.932144 1.700621
O 7.060038 -0.470346 -0.566696
N 0.300118 0.262084 -0.675494
N -7.371165 0.823793 1.655382
C 1.667364 0.080720 -0.389519
C 4.331705 -0.360608 0.276834
C 1.999945 -0.656607 0.784232
C 2.699845 0.595148 -1.227069
C 3.342060 -0.880504 1.130983
C 4.047200 0.375504 -0.886118
C -1.813858 0.909307 -1.711299
C -0.280131 0.917347 -1.753676
C -3.549274 0.230902 -0.105568
C -3.732313 1.142224 0.959737
C -4.673646 -0.487822 -0.568320
C -6.119130 0.629362 1.078738
C -4.985216 1.353427 1.554114
C -5.941986 -0.298559 0.008667
H 1.203949 -1.052290 1.424838
H 2.432997 1.156709 -2.124179
H 3.611594 -1.450648 2.024930
H 4.854177 0.758229 -1.518584
H -0.397225 -0.137391 -0.029676
H -2.169974 1.936713 -1.505335
H -2.195619 0.585176 -2.696624
H -4.531071 -1.208127 -1.380523
H -5.084388 2.065238 2.379612
H -6.799464 -0.870388 -0.363189
H -7.501138 1.479578 2.420036
H -8.181474 0.308453 1.324540


