%chk=000191914.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191914

0 1
S 1.859421 -0.624918 1.185259
O 1.878464 0.546407 2.022824
O 2.459182 -1.852735 1.684198
O 1.788608 1.582539 -1.074694
N 2.828439 -0.286476 -0.222544
N -4.321090 0.028638 -0.773564
C 4.059114 -1.091900 -0.491092
C 4.737997 -0.430163 -1.713413
C 3.866152 0.773470 -2.100455
C 2.708266 0.796712 -1.119173
C 0.299862 -0.991168 0.563447
C -0.718998 -0.006729 0.365442
C -1.995220 -0.435920 -0.110665
C 0.049569 -2.321724 0.276095
C -3.044795 0.542543 -0.289222
C -0.514809 1.386472 0.620095
C -2.203753 -1.810502 -0.420939
C -1.202260 -2.737653 -0.229096
C -2.805923 1.874782 -0.032510
C -1.522500 2.292664 0.415099
C -5.008629 0.955033 -1.719393
C -5.211534 -0.340202 0.369804
H 3.779893 -2.147515 -0.692303
H 4.722217 -1.091944 0.400735
H 4.824626 -1.144540 -2.550162
H 5.766543 -0.113413 -1.467120
H 3.484679 0.701646 -3.136062
H 4.422356 1.728761 -2.046523
H 0.822666 -3.084912 0.444200
H 0.466986 1.743287 0.963842
H -3.175110 -2.118896 -0.824516
H -1.361781 -3.788890 -0.461474
H -3.581476 2.625972 -0.161225
H -1.354478 3.355342 0.598909
H -4.305031 1.252718 -2.514956
H -5.423274 1.866013 -1.263527
H -5.833265 0.403197 -2.200934
H -5.560824 0.515987 0.966788
H -4.677848 -1.030617 1.043585
H -6.091142 -0.873265 -0.025258


%chk=000191914-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191914

0 1
S 1.915337 -0.523090 1.210258
O 1.959179 0.815981 2.118170
O 2.477575 -1.921416 1.828841
O 2.052495 1.613606 -1.230591
N 3.041470 -0.321855 -0.282381
N -4.483600 0.167581 -0.688734
C 4.308391 -1.094684 -0.337003
C 4.810874 -0.743199 -1.768378
C 4.242197 0.674499 -2.039921
C 2.971968 0.759895 -1.171779
C 0.186693 -0.873598 0.478753
C -0.797263 0.152314 0.287074
C -2.099807 -0.319099 -0.176588
C 0.000086 -2.225178 0.205428
C -3.186613 0.636205 -0.332404
C -0.579021 1.553677 0.483048
C -2.266916 -1.695634 -0.527994
C -1.248199 -2.634141 -0.344722
C -2.910464 2.005798 -0.170153
C -1.615719 2.449751 0.220930
C -5.397742 1.107587 -1.357053
C -5.188026 -0.745245 0.243287
H 4.118077 -2.168367 -0.187153
H 5.011918 -0.752840 0.445898
H 4.389282 -1.462398 -2.491938
H 5.910355 -0.789985 -1.832546
H 3.994572 0.870134 -3.095254
H 4.931600 1.471481 -1.701222
H 0.794796 -2.947207 0.417750
H 0.396359 1.914647 0.809121
H -3.212990 -1.999792 -0.985047
H -1.396449 -3.681586 -0.624278
H -3.705988 2.744376 -0.307140
H -1.439211 3.523355 0.347193
H -4.864488 1.656170 -2.151031
H -5.858576 1.847884 -0.661343
H -6.218498 0.533700 -1.824110
H -5.811255 -0.174805 0.968849
H -4.469035 -1.345550 0.819812
H -5.852063 -1.430871 -0.316146


