%chk=000284763.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284763

0 1
S -0.887439 -3.077009 0.008571
O -2.262974 1.266527 -1.066818
O -0.618708 2.105078 0.604988
O 1.047657 2.663668 -0.644336
O -3.232800 0.849495 0.928399
N 0.396621 1.844928 -0.020805
N -2.085180 -1.847298 0.024349
C -0.058278 -0.624148 0.019152
C 0.869681 0.442989 -0.004455
C 2.250126 0.171050 -0.013240
C 0.437123 -1.948582 0.011830
C -1.531547 -0.656224 0.035727
C 1.806754 -2.235599 0.003666
C 2.697903 -1.176894 -0.003777
C 3.265620 1.256739 -0.026273
C -2.435403 0.539775 0.086499
H 2.160488 -3.268708 0.003489
H 3.772767 -1.371343 -0.007281
H 3.132634 1.966664 0.807124
H 4.299567 0.891454 0.026833
H 3.184188 1.868546 -0.947290
H -2.785001 2.119492 -1.056750


%chk=000284763-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000284763

0 1
S -0.931464 -3.154874 0.137339
O -2.086362 1.333358 -1.117399
O -0.470943 2.060031 1.094853
O 0.900718 2.731970 -0.596772
O -3.482345 0.751621 0.660813
N 0.401921 1.827468 0.171233
N -2.162928 -1.836434 0.133715
C -0.082387 -0.631212 0.047785
C 0.870663 0.430540 0.020304
C 2.263310 0.194362 -0.060769
C 0.423950 -1.967290 0.051587
C -1.545599 -0.644269 0.074057
C 1.805367 -2.245724 -0.004211
C 2.699820 -1.165185 -0.071761
C 3.302267 1.297839 -0.099864
C -2.477642 0.533615 -0.035641
H 2.177297 -3.274324 0.006235
H 3.776036 -1.361654 -0.116804
H 3.117549 2.079335 0.657979
H 4.307646 0.880233 0.072467
H 3.295620 1.809972 -1.077543
H -2.678696 2.131222 -1.178000


