%chk=000268504.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268504

0 1
S 1.578848 1.639701 -0.002809
O 0.595770 -2.644198 0.002907
C -0.244516 -0.439738 0.003788
C -0.023421 0.937830 0.001172
C -2.648065 -0.022032 0.009882
C -1.569607 -0.912811 0.007869
C 0.854912 -1.453727 0.002620
C -1.090566 1.846137 0.001747
C 2.679569 0.271547 -0.001356
C -2.397544 1.364504 0.005775
C 2.255395 -0.996250 0.001030
C -4.049425 -0.536342 0.000532
C 4.092808 0.716089 -0.003225
H -1.736558 -1.995668 0.008948
H -0.908680 2.921697 -0.000788
H -3.231811 2.065771 0.005310
H 2.971962 -1.828259 0.001868
H -4.153933 -1.464049 0.581520
H -4.766709 0.182829 0.417287
H -4.375223 -0.762677 -1.026591
H 4.337314 1.326540 0.882521
H 4.335765 1.324240 -0.890966
H 4.797015 -0.132133 -0.002742


%chk=000268504-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268504

0 1
S 1.623691 1.750113 -0.056077
O 0.598716 -2.686316 0.104048
C -0.239404 -0.422589 0.016565
C -0.028813 0.980684 -0.034885
C -2.689375 -0.039516 -0.008346
C -1.580060 -0.903293 0.028451
C 0.862664 -1.435020 0.059510
C -1.131791 1.871199 -0.073010
C 2.721155 0.312037 0.004415
C -2.441278 1.363770 -0.059739
C 2.259272 -0.978419 0.050448
C -4.111185 -0.570221 0.006397
C 4.184570 0.689160 -0.002103
H -1.704966 -1.991362 0.068089
H -0.962274 2.952974 -0.112620
H -3.286850 2.061632 -0.089550
H 2.996217 -1.790538 0.085121
H -4.129057 -1.672299 0.036341
H -4.668691 -0.198512 0.886718
H -4.669768 -0.246433 -0.891881
H 4.439185 1.327431 0.864470
H 4.450651 1.251566 -0.916502
H 4.810691 -0.217046 0.040438


