%chk=000184706.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184706

0 1
S -2.362221 -0.679777 -1.241660
O -1.779526 -0.262909 -2.499630
O -2.276424 -2.082911 -0.929459
O 0.336325 -1.230100 1.867004
N -1.237285 0.136046 -0.058648
N 0.098211 -0.252700 -0.204718
C -1.629261 1.037319 0.915958
C -4.001233 0.933609 0.136169
C -3.801596 0.026898 -0.867160
C -2.962564 1.405034 0.986024
C -0.628514 1.591437 1.869184
C 2.082005 -1.614781 0.238808
C 0.768396 -1.047081 0.747642
C -5.372414 1.480502 0.386913
C 3.022510 -0.563296 -0.273854
C 3.238319 -0.417829 -1.652081
C 3.687940 0.278149 0.630945
C 4.116439 0.564177 -2.119410
C 4.563787 1.257519 0.156320
C 4.779282 1.403093 -1.218189
H -4.658781 -0.279572 -1.473795
H -3.243994 2.113341 1.765679
H 0.504613 -0.002746 -1.118456
H 1.870645 -2.391545 -0.531065
H 2.555731 -2.181591 1.076407
H -1.031652 2.402832 2.489573
H 0.269374 1.978613 1.363983
H -0.280397 0.794210 2.562792
H -5.380922 2.579654 0.336027
H -5.729392 1.201839 1.390725
H -6.120931 1.119029 -0.331124
H 2.730590 -1.069820 -2.361760
H 3.524544 0.165694 1.701921
H 4.283723 0.674469 -3.190610
H 5.081724 1.908206 0.859979
H 5.462848 2.166486 -1.585336


%chk=000184706-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184706

0 1
S -1.594246 0.615261 -1.647948
O -1.378570 1.934068 -2.569184
O -0.751514 -0.727936 -2.050585
O -0.371555 -1.229627 1.619421
N -0.864013 1.184746 0.189756
N 0.377779 0.621109 0.409755
C -1.763913 1.395773 1.232429
C -3.863380 0.737495 -0.046952
C -3.329007 0.278357 -1.233218
C -3.144011 1.344407 1.049778
C -1.159752 1.742767 2.579851
C 1.968072 -1.247280 0.860322
C 0.556321 -0.655151 0.993540
C -5.357156 0.518365 0.160077
C 2.917381 -0.592334 -0.133747
C 2.598223 -0.549248 -1.519747
C 4.150629 -0.044025 0.302402
C 3.497816 0.032174 -2.440536
C 5.051456 0.534959 -0.620794
C 4.726778 0.574469 -1.996057
H -3.831162 -0.336257 -1.982607
H -3.750251 1.669104 1.900894
H 1.139899 1.008610 -0.157417
H 1.797189 -2.308909 0.599368
H 2.406955 -1.251470 1.876228
H -1.917207 2.233235 3.212208
H -0.291418 2.414798 2.471511
H -0.827693 0.820969 3.090330
H -5.861734 1.493673 0.292660
H -5.538729 -0.080125 1.070945
H -5.826958 0.006275 -0.695272
H 1.643803 -0.958511 -1.875292
H 4.409838 -0.075229 1.368141
H 3.236011 0.062398 -3.503745
H 6.001377 0.951600 -0.267748
H 5.422639 1.022987 -2.713669


