%chk=000203020.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203020

0 1
S 3.148714 -1.659831 -0.265369
O -1.550601 -0.270179 -0.114359
O -2.723711 1.657819 0.438675
N -3.753452 -0.430068 0.189958
C 0.746025 -0.718950 -0.132031
C 2.087167 -0.287963 -0.045628
C 2.444095 1.048857 0.185342
C -0.264277 0.257528 0.019833
C 1.405839 1.973933 0.330952
C 0.054704 1.590537 0.248811
C 0.618957 -2.147323 -0.373118
C 3.875614 1.454890 0.270841
C 1.808631 -2.781316 -0.467379
C -2.702350 0.476163 0.189080
C -5.138776 0.084168 0.139455
H 1.636544 3.024013 0.512689
H -0.730900 2.343774 0.369387
H -0.358590 -2.605022 -0.459318
H 4.415127 1.221594 -0.659947
H 4.000445 2.530533 0.452445
H 4.393296 0.929174 1.087930
H 2.004818 -3.825335 -0.640322
H -3.597842 -1.381870 -0.135574
H -5.786029 -0.563693 0.756484
H -5.534602 0.115502 -0.889555
H -5.190947 1.109464 0.557516


%chk=000203020-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203020

0 1
S 3.248197 -1.686223 -0.310970
O -1.582586 -0.286930 -0.000534
O -2.836243 1.712450 0.398327
N -3.831230 -0.380012 0.011263
C 0.755552 -0.723357 -0.105424
C 2.114597 -0.290339 -0.042964
C 2.495307 1.052156 0.196571
C -0.267651 0.249247 0.083669
C 1.437261 1.970453 0.376193
C 0.067640 1.593066 0.323950
C 0.621269 -2.144197 -0.362919
C 3.950223 1.470901 0.255342
C 1.829007 -2.791902 -0.495631
C -2.771671 0.482843 0.162550
C -5.220894 0.071539 0.114353
H 1.680166 3.022536 0.564671
H -0.717521 2.335204 0.468796
H -0.345101 -2.644396 -0.442389
H 4.473207 1.244778 -0.693865
H 4.046639 2.552788 0.446035
H 4.491637 0.934077 1.058055
H 2.017766 -3.846463 -0.690068
H -3.615987 -1.358736 -0.178577
H -5.747327 -0.437351 0.942739
H -5.771541 -0.110246 -0.826903
H -5.212816 1.154513 0.314528


