%chk=000256553.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256553

0 1
Cl -6.012148 -0.417761 -2.029265
S 3.156384 -2.660624 -0.827162
N -1.664802 -0.808777 0.694162
N 1.223431 -1.083087 0.015622
C -1.155983 -1.743042 -0.361177
C -0.568795 -0.129570 1.439428
C 0.274703 -2.228518 -0.082687
C 0.645989 0.183820 0.547993
C -2.835041 -0.064639 0.377491
C 2.529881 -1.210786 -0.314789
C -3.727473 -0.524849 -0.619027
C -3.191782 1.076503 1.138572
C 3.428494 -0.036980 -0.217533
C -4.926554 0.157281 -0.807579
C -4.401905 1.727483 0.916110
C 4.352467 0.043709 0.834925
C 3.389145 0.960991 -1.203402
C -5.292243 1.279432 -0.066827
C 5.224574 1.133350 0.906314
C 4.268155 2.044098 -1.126098
C 5.182237 2.133380 -0.070696
H -1.201739 -1.276634 -1.373205
H -1.836798 -2.628811 -0.371802
H -0.274806 -0.814507 2.271869
H -0.928512 0.807689 1.925821
H 0.324851 -2.823439 0.860041
H 0.591513 -2.921832 -0.906094
H 0.351655 0.838418 -0.305309
H 1.414207 0.741848 1.131708
H -3.510844 -1.402204 -1.222735
H -2.522755 1.444407 1.916155
H -4.661899 2.601490 1.515614
H 4.401182 -0.749533 1.582046
H 2.690525 0.880708 -2.035449
H -6.236680 1.787578 -0.243177
H 5.945899 1.196855 1.720254
H 4.246117 2.816063 -1.894245
H 5.867546 2.978191 -0.014670


%chk=000256553-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256553

0 1
Cl -6.514434 -0.979380 -1.624559
S 2.989155 -2.855489 0.264389
N -1.621930 -0.228563 0.082002
N 1.237549 -0.826511 -0.183593
C -1.137698 -1.284096 -0.826649
C -0.592016 0.573842 0.766923
C 0.197193 -1.875050 -0.341388
C 0.720864 0.561309 -0.040572
C -2.985992 0.046857 0.237683
C 2.542416 -1.202634 0.054947
C -3.953745 -0.522346 -0.649709
C -3.454628 0.905495 1.282457
C 3.595293 -0.138256 0.081560
C -5.313269 -0.231189 -0.462389
C -4.828896 1.177651 1.424657
C 4.585207 -0.153351 1.100042
C 3.681663 0.844018 -0.944642
C -5.792803 0.612522 0.556263
C 5.620168 0.804437 1.107917
C 4.732659 1.786950 -0.948610
C 5.699889 1.777385 0.082742
H -1.037485 -0.914280 -1.871031
H -1.866664 -2.114448 -0.844208
H -0.399071 0.210508 1.799521
H -0.929902 1.625236 0.841166
H 0.063133 -2.404475 0.622861
H 0.566996 -2.630570 -1.057971
H 0.538514 1.010180 -1.036724
H 1.475407 1.176157 0.473433
H -3.655185 -1.154893 -1.488482
H -2.753040 1.334931 2.003071
H -5.162468 1.832506 2.237293
H 4.535635 -0.933153 1.866891
H 2.951228 0.841163 -1.761953
H -6.859901 0.816477 0.669644
H 6.371072 0.785803 1.905292
H 4.800287 2.521296 -1.758896
H 6.512994 2.511661 0.081822


