%chk=000192749.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192749

0 1
S 3.049870 -1.121666 -0.494986
O 3.291157 -2.465848 -0.003190
O 3.571148 -0.725426 -1.774567
O -2.955275 1.956268 -1.499080
O -3.431814 -1.510037 1.557425
O 3.037893 1.820761 0.079328
N -2.744082 0.128015 -0.008093
N 3.871221 -0.177330 0.735226
C 1.390706 -0.738014 -0.341936
C -1.342278 -0.164303 -0.121926
C 0.867623 0.429298 -0.913031
C 0.536701 -1.617451 0.339120
C -0.491897 0.721575 -0.808445
C -0.821594 -1.341808 0.455446
C -3.447027 1.188072 -0.724339
C -3.690768 -0.587236 0.839493
C -4.887292 1.085369 -0.271643
C -5.023771 0.089763 0.607458
C 3.799495 1.225002 0.820131
C 4.667936 1.880777 1.849641
H 1.532060 1.133020 -1.439280
H 0.939349 -2.539082 0.781213
H -0.874590 1.639752 -1.265597
H -1.467183 -2.040977 0.995122
H 4.499686 -0.678857 1.377887
H -5.624449 1.771569 -0.666471
H -5.903129 -0.261712 1.130126
H 5.737449 1.736742 1.637637
H 4.489316 2.969607 1.861613
H 4.474939 1.510655 2.865319


%chk=000192749-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192749

0 1
S 3.113122 -1.061755 -0.575574
O 3.353499 -2.599960 -0.104884
O 3.662151 -0.521447 -1.993933
O -3.225087 1.405906 -2.039339
O -3.326218 -0.985337 2.035452
O 3.266298 1.984080 0.187541
N -2.833056 0.127345 -0.039174
N 3.951284 -0.145922 0.823988
C 1.287028 -0.649114 -0.383393
C -1.427965 -0.138636 -0.158533
C 0.790825 0.530660 -0.956343
C 0.492125 -1.589135 0.289543
C -0.589271 0.787278 -0.834984
C -0.888032 -1.328111 0.398968
C -3.628293 0.878337 -0.978272
C -3.679462 -0.312126 1.040202
C -5.028960 0.891121 -0.433853
C -5.058021 0.202983 0.737076
C 3.960346 1.242213 0.936747
C 4.875041 1.777881 2.037442
H 1.459446 1.234987 -1.457132
H 0.933080 -2.505799 0.693202
H -1.007061 1.695079 -1.272395
H -1.532317 -2.036563 0.921718
H 4.543792 -0.772581 1.381782
H -5.836768 1.396775 -0.962501
H -5.894690 0.009431 1.408041
H 5.818403 2.125586 1.579138
H 4.386170 2.645151 2.509026
H 5.113990 1.028171 2.810043


