%chk=000291468.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291468

0 1
S -0.946925 -0.429497 0.810337
O -0.766900 -1.862057 0.962767
O -0.647502 0.462919 1.908169
N -0.002770 0.068001 -0.556667
N 3.656479 -0.739011 -0.430106
C 1.414754 0.200642 -0.327753
C 1.937097 1.441356 0.110937
C 2.310634 -0.877629 -0.568973
C -2.549373 -0.135131 0.223260
C 3.325071 1.560322 0.259962
C 4.157085 0.463159 -0.022859
C 1.042934 2.585719 0.435473
C 1.817886 -2.226417 -0.974860
C -3.389040 -1.215110 -0.068789
C -3.008713 1.175689 0.065369
C 5.640411 0.561868 0.117744
C -4.687664 -0.984215 -0.530629
C -4.307617 1.408704 -0.397719
C -5.145140 0.328286 -0.695520
H -0.184844 -0.418931 -1.446809
H 3.759145 2.496650 0.599260
H 1.584736 3.518333 0.627558
H 0.317548 2.773363 -0.368946
H 0.452677 2.350583 1.347156
H 1.059081 -2.606092 -0.262144
H 1.378262 -2.220960 -1.978882
H 2.634340 -2.968939 -0.986991
H -3.031338 -2.242820 0.070825
H -2.358069 2.021852 0.306786
H 5.926004 0.776095 1.157555
H 6.050947 1.359615 -0.515908
H 6.143318 -0.376975 -0.169088
H -5.343043 -1.824142 -0.757165
H -4.667028 2.429245 -0.521728
H -6.159243 0.509325 -1.054921


%chk=000291468-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291468

0 1
S -1.008220 -0.823785 0.780802
O -1.162964 -2.452802 0.881993
O -0.459837 0.062224 2.034747
N 0.162891 -0.353278 -0.850549
N 3.852939 -0.686100 -0.309350
C 1.497553 -0.032309 -0.498710
C 1.816973 1.321210 -0.149085
C 2.552019 -1.011106 -0.548248
C -2.688550 -0.140616 0.257200
C 3.173092 1.619980 0.099043
C 4.165320 0.610737 0.017510
C 0.746139 2.380581 -0.048434
C 2.262924 -2.463486 -0.872185
C -3.589809 -1.031054 -0.348461
C -2.975122 1.208902 0.518795
C 5.621121 0.907276 0.303202
C -4.856525 -0.526254 -0.724133
C -4.247363 1.693371 0.137149
C -5.179799 0.830543 -0.486687
H 0.109331 -1.281804 -1.318384
H 3.465075 2.642760 0.362315
H 1.168982 3.391131 -0.178581
H -0.043238 2.209496 -0.800752
H 0.268583 2.330739 0.948858
H 1.512598 -2.893779 -0.182316
H 1.884222 -2.595753 -1.905652
H 3.198938 -3.033961 -0.781078
H -3.318582 -2.082012 -0.491775
H -2.245024 1.847578 1.025516
H 5.761760 1.248493 1.346276
H 6.005121 1.708705 -0.355562
H 6.220932 -0.001971 0.146204
H -5.586755 -1.192711 -1.194629
H -4.508149 2.739019 0.330594
H -6.163376 1.213839 -0.778932


