%chk=000285710.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285710

0 1
S 1.663754 -1.648241 0.450437
O 2.364579 -2.154894 1.610041
O 1.544635 -2.431390 -0.757659
O -5.614593 0.481668 0.124920
O -4.639889 0.570099 2.131664
N 0.072475 -1.360845 1.074031
C 2.228839 -0.074898 0.061170
C -1.098110 -1.121570 0.315220
C 2.945875 0.663854 1.011389
C 1.988540 0.472391 -1.205331
C 3.162484 2.496865 -0.563528
C 3.409229 1.942045 0.705403
C 2.448363 1.750381 -1.518283
C -2.223555 -0.576601 0.970459
C -1.162604 -1.399862 -1.067242
C -3.379783 -0.300723 0.233017
C -2.325268 -1.111251 -1.778704
C 3.641550 3.870364 -0.889134
C -3.440806 -0.557036 -1.141332
C -4.537420 0.275721 0.961982
H -0.071319 -1.431387 2.091311
H 3.152749 0.233005 1.998558
H 1.443403 -0.106086 -1.959725
H 3.964563 2.510361 1.449936
H 2.255022 2.170031 -2.504249
H -2.204186 -0.365085 2.041301
H -0.322413 -1.882023 -1.582745
H -2.369025 -1.331014 -2.846698
H 2.876810 4.620592 -0.629840
H 4.553913 4.142078 -0.339145
H 3.864183 3.998518 -1.958124
H -4.351293 -0.333186 -1.699479
H -6.396002 0.863920 0.608678


%chk=000285710-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000285710

0 1
S 1.815375 -1.938066 0.298057
O 2.765002 -2.472677 1.499731
O 1.721890 -2.646141 -1.158256
O -4.896335 1.364184 -0.171080
O -3.592375 1.593592 1.735953
N 0.041136 -2.082064 1.051236
C 2.186468 -0.105074 0.024334
C -1.040449 -1.561417 0.294643
C 2.826482 0.597811 1.059066
C 1.817075 0.479148 -1.198415
C 2.732179 2.614090 -0.361935
C 3.099351 1.966693 0.848968
C 2.098758 1.851398 -1.378975
C -1.845577 -0.502645 0.787847
C -1.358530 -2.160268 -0.960275
C -2.980080 -0.074197 0.056985
C -2.466389 -1.696423 -1.697671
C 3.001774 4.094068 -0.557688
C -3.289901 -0.663913 -1.195494
C -3.806015 1.015990 0.641837
H 0.132989 -1.711962 2.013094
H 3.129917 0.083675 1.977028
H 1.353986 -0.121226 -1.987655
H 3.608728 2.537579 1.633696
H 1.826522 2.332555 -2.325100
H -1.618870 -0.012082 1.742342
H -0.738322 -2.983732 -1.325146
H -2.703069 -2.161584 -2.660210
H 2.164971 4.700059 -0.159661
H 3.916925 4.413205 -0.029597
H 3.113473 4.349606 -1.625280
H -4.164721 -0.315165 -1.750129
H -5.407672 2.090781 0.276049


