%chk=000292315.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292315

0 1
S -1.400577 2.369176 -0.486127
O 0.069696 1.928808 0.220729
O 2.877271 0.529035 -0.809842
O -1.292083 2.034067 -1.879482
O -1.668340 3.715602 -0.063113
O -4.371549 -3.014571 0.746929
O -3.043267 -2.616842 -0.916768
N -3.633452 -2.293413 0.097736
C -2.430573 1.266001 0.354972
C 1.272357 2.202198 -0.528106
C 2.364777 1.432894 0.212699
C -2.600880 -0.034448 -0.121349
C -3.088258 1.690196 1.517298
C -3.440257 -0.908842 0.586390
C -3.923199 0.810383 2.215180
C -4.103244 -0.494237 1.755432
C 3.846275 -0.382261 -0.445707
C 4.407301 -0.502633 0.830032
C 4.238763 -1.209976 -1.518746
C 5.389036 -1.482412 1.029088
C 5.215361 -2.172171 -1.288194
C 5.793945 -2.312390 -0.016288
H 1.161628 1.830878 -1.572916
H 1.441757 3.294071 -0.520041
H 3.189591 2.077238 0.558670
H 1.944399 0.844343 1.051252
H -2.097696 -0.382905 -1.039254
H -2.954151 2.719509 1.880266
H -4.434433 1.145193 3.120078
H -4.753142 -1.200061 2.289561
H 4.104467 0.133076 1.653044
H 3.774066 -1.082365 -2.493331
H 5.838407 -1.592281 2.016129
H 5.534419 -2.824113 -2.101797
H 6.556186 -3.069044 0.149676


%chk=000292315-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292315

0 1
S -1.372935 2.862218 -0.381825
O 0.284339 3.040821 0.498078
O 1.961805 0.734292 -0.453378
O -1.081535 2.673292 -1.966571
O -2.330839 4.031311 0.182162
O -2.089399 -3.530997 0.182739
O -0.890202 -2.404961 -1.396464
N -1.646213 -2.445992 -0.352434
C -1.954767 1.225716 0.344991
C 1.448391 3.100303 -0.410732
C 2.456413 2.037265 0.004626
C -1.536570 0.044126 -0.278752
C -2.811276 1.276483 1.457232
C -2.035586 -1.153154 0.275252
C -3.278381 0.050348 1.985731
C -2.892563 -1.172173 1.397876
C 2.762705 -0.393637 -0.165807
C 3.979479 -0.339607 0.558735
C 2.273891 -1.628170 -0.658219
C 4.699090 -1.536517 0.787944
C 3.002556 -2.809905 -0.419170
C 4.219589 -2.773175 0.305595
H 1.125951 2.943185 -1.460256
H 1.889120 4.109987 -0.313377
H 3.435534 2.262119 -0.469916
H 2.581469 2.038711 1.105838
H -0.868563 0.037979 -1.144933
H -3.110139 2.240679 1.880680
H -3.945747 0.053096 2.852329
H -3.243772 -2.132575 1.784072
H 4.374827 0.605214 0.943198
H 1.337959 -1.650123 -1.224566
H 5.639877 -1.493615 1.348452
H 2.617033 -3.760750 -0.802810
H 4.783059 -3.694090 0.487780


