%chk=000249117.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249117

0 1
Cl -5.692269 -0.093785 0.573960
O 2.595450 -3.024648 0.003731
O -1.856803 2.115863 -0.190249
N 0.862377 -1.688446 0.784920
N -0.540800 0.252095 0.050251
C -0.467798 -1.228999 0.300976
C -0.737944 -2.042213 -1.000975
C 0.440710 -3.007615 -1.168773
C 1.707595 -0.694502 1.492239
C 1.470214 -2.608841 -0.127672
C 0.696929 0.990879 -0.075477
C 1.827054 0.548160 0.651814
C -1.790487 0.920039 0.018185
C 0.789823 2.125723 -0.896335
C 3.030023 1.250646 0.552271
C -3.027778 0.067297 0.236569
C 1.999092 2.820774 -0.974510
C 3.116246 2.389904 -0.253694
C -4.254136 0.958441 0.382656
H -1.216847 -1.478463 1.105390
H -0.822357 -1.373413 -1.878745
H -1.695032 -2.585947 -0.930206
H 0.887376 -2.955498 -2.180770
H 0.143368 -4.064850 -1.027016
H 2.701310 -1.159579 1.703080
H 1.237622 -0.463574 2.476645
H -0.081570 2.483125 -1.450910
H 3.905791 0.908964 1.104126
H -2.919219 -0.580380 1.135755
H -3.164818 -0.629357 -0.620390
H 2.066384 3.707886 -1.604648
H 4.054389 2.937800 -0.320941
H -4.409942 1.601200 -0.507469
H -4.189051 1.617416 1.270612


%chk=000249117-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249117

0 1
Cl -5.785106 -0.198269 0.616801
O 2.567783 -3.192422 0.105858
O -1.901613 2.199105 0.118950
N 0.892172 -1.610401 0.599223
N -0.533952 0.292463 0.062876
C -0.444286 -1.203634 0.149005
C -0.604853 -1.962250 -1.208663
C 0.348320 -3.177375 -1.080105
C 1.689789 -0.696986 1.429381
C 1.423404 -2.704234 -0.089066
C 0.696972 1.047094 -0.081608
C 1.840708 0.590299 0.633692
C -1.778437 0.938751 0.179022
C 0.780331 2.205993 -0.888653
C 3.057837 1.292593 0.524981
C -3.018865 0.053547 0.390041
C 2.001286 2.910323 -0.970240
C 3.141454 2.460506 -0.266473
C -4.281802 0.920362 0.366201
H -1.205965 -1.535642 0.879863
H -0.269368 -1.293627 -2.021106
H -1.650529 -2.249596 -1.404373
H 0.819579 -3.477703 -2.029023
H -0.161102 -4.066799 -0.664617
H 2.659778 -1.185242 1.622217
H 1.182066 -0.525372 2.399300
H -0.100212 2.565039 -1.423208
H 3.940549 0.921451 1.058311
H -2.958211 -0.471535 1.363473
H -3.091177 -0.726308 -0.389788
H 2.059269 3.811658 -1.589783
H 4.087336 3.007183 -0.341076
H -4.432377 1.422793 -0.598253
H -4.305875 1.654335 1.181242


