%chk=000279298.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279298

0 1
Cl -3.036575 2.623117 0.090413
S 1.994039 -1.389010 1.290816
N 1.570939 0.346816 -0.626871
C 3.396949 -0.646365 0.567474
C 2.977122 0.260633 -0.445274
C 0.917769 -0.438426 0.189387
C -2.855245 -0.055942 -0.233903
C 4.743321 -0.837508 0.858721
C 3.929342 0.987496 -1.177562
C -0.512377 -0.633735 0.311849
C -1.402278 0.137194 -0.337223
C 5.680281 -0.108899 0.123577
C 5.276051 0.791253 -0.880856
C -3.711090 1.043305 -0.049166
C -3.432733 -1.333060 -0.337076
C -5.096444 0.896519 0.037804
C -4.818445 -1.493273 -0.257332
C -5.649104 -0.383224 -0.069341
H 5.058962 -1.532323 1.634912
H 3.606633 1.681889 -1.952419
H -0.831874 -1.443569 0.975988
H -1.076682 0.964104 -0.985679
H 6.742747 -0.236324 0.328090
H 6.034967 1.344015 -1.435070
H -2.791852 -2.202069 -0.490376
H -5.735292 1.767530 0.186146
H -5.253453 -2.488787 -0.342386
H -6.729280 -0.513155 -0.006342


%chk=000279298-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279298

0 1
Cl -3.039435 2.583470 -1.168292
S 2.099044 -1.998622 0.674824
N 1.573481 0.461692 -0.319148
C 3.468587 -0.900980 0.249340
C 2.968484 0.349743 -0.258879
C 0.951673 -0.625009 0.110558
C -2.857781 -0.057372 -0.156748
C 4.850645 -1.146856 0.363699
C 3.882533 1.358594 -0.654150
C -0.478363 -0.851555 0.187329
C -1.400184 0.090676 -0.201186
C 5.744214 -0.127838 -0.035849
C 5.263164 1.112604 -0.539704
C -3.726647 0.996131 -0.569305
C -3.498428 -1.253870 0.295550
C -5.129167 0.887693 -0.541595
C -4.897096 -1.383746 0.332309
C -5.721024 -0.310908 -0.087359
H 5.229782 -2.097595 0.750279
H 3.494052 2.305678 -1.039439
H -0.788117 -1.827308 0.578935
H -1.009732 1.042771 -0.578773
H 6.823017 -0.299037 0.044920
H 5.978262 1.884890 -0.842145
H -2.877485 -2.094583 0.621502
H -5.746498 1.728322 -0.870400
H -5.348840 -2.316537 0.685369
H -6.811745 -0.402248 -0.063339


