%chk=000208089.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208089

0 1
S 3.375182 1.138623 0.895223
O 0.870298 -2.465790 -0.378726
N -1.542717 -0.153982 0.425061
C -0.962269 -0.927772 -0.714484
C -2.780469 0.607905 0.074174
C 0.491033 -1.317265 -0.368682
C -1.798893 -2.187647 -0.950504
C -2.532417 1.757107 -0.919821
C -3.374489 1.145375 1.383110
C 1.428756 -0.201721 -0.056869
C 1.324738 1.128338 -0.619862
C 2.500257 -0.349449 0.780772
C 2.309509 1.967713 -0.199162
H -0.923674 -0.333814 -1.669191
H -3.505060 -0.116490 -0.383690
H -0.843591 0.475049 0.836595
H -2.010566 -2.699199 0.000692
H -2.758833 -1.956311 -1.420411
H -1.263547 -2.906847 -1.584166
H -3.461773 2.298285 -1.130032
H -1.818976 2.489790 -0.529954
H -2.150731 1.389980 -1.877425
H -3.487940 0.336411 2.118361
H -4.362670 1.584804 1.216124
H -2.743018 1.911972 1.843731
H 0.537690 1.397487 -1.312434
H 2.800603 -1.242619 1.310554
H 2.469069 2.998667 -0.464182


%chk=000208089-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208089

0 1
S 3.680412 1.058521 0.644853
O 0.784021 -2.516280 0.086455
N -1.610209 -0.138850 0.404022
C -0.955179 -0.944973 -0.660011
C -2.837677 0.624289 0.055863
C 0.465034 -1.321680 -0.170727
C -1.772473 -2.201277 -1.004033
C -2.615503 1.758599 -0.984805
C -3.441499 1.182932 1.360821
C 1.452437 -0.208857 -0.010635
C 1.284902 1.163964 -0.463142
C 2.687478 -0.416564 0.601567
C 2.374366 1.969615 -0.198849
H -0.808066 -0.352980 -1.602585
H -3.557621 -0.099834 -0.372254
H -0.947895 0.434347 0.945396
H -1.880207 -2.833718 -0.108603
H -2.776711 -1.928200 -1.373705
H -1.264351 -2.792337 -1.786171
H -3.577645 2.221232 -1.273337
H -1.971187 2.553536 -0.560912
H -2.141973 1.377266 -1.909683
H -3.646040 0.362684 2.069641
H -4.382370 1.726883 1.160905
H -2.739739 1.890736 1.845253
H 0.395283 1.526901 -0.982048
H 3.060356 -1.349524 1.021040
H 2.527561 3.022168 -0.429514


