%chk=000297430.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297430

0 1
S 1.268616 -1.242226 -0.868972
O -1.884024 0.475373 0.851531
O 0.074651 -0.093142 1.845613
O 1.356696 -1.206870 -2.312486
O 1.175752 -2.506995 -0.192724
N -0.227356 -0.388002 -0.473851
C -2.466537 0.434552 -0.525383
C -2.804564 1.880992 -0.888735
C -3.669394 -0.507108 -0.455997
C -3.954715 2.423249 -0.031025
C -4.801708 0.085640 0.391428
C -5.176134 1.496436 -0.080360
C -1.319646 -0.137917 -1.374298
C -0.603950 -0.020424 0.853808
C -1.343319 -0.346886 -2.686528
C 2.477429 -0.247575 -0.188823
C 3.200166 0.627245 -1.014694
C 2.777407 -0.314978 1.179151
C 4.209379 1.424724 -0.483511
C 3.789309 0.480433 1.716150
C 4.512949 1.356485 0.890175
C 5.583211 2.219471 1.466787
H -3.070208 1.931853 -1.963696
H -1.907312 2.518952 -0.759951
H -3.356487 -1.483915 -0.033359
H -4.026966 -0.716154 -1.484109
H -4.228644 3.439207 -0.369813
H -3.607829 2.526358 1.018625
H -4.480522 0.120379 1.453718
H -5.684273 -0.579301 0.355410
H -5.983705 1.904075 0.556674
H -5.586021 1.459178 -1.107221
H -0.504535 -0.752284 -3.252833
H -2.200607 -0.130229 -3.304165
H 2.973641 0.678077 -2.086971
H 2.207368 -0.987163 1.836813
H 4.764851 2.100967 -1.130481
H 4.009920 0.424451 2.781340
H 6.113421 1.731714 2.297617
H 6.343336 2.506725 0.727073
H 5.155057 3.153035 1.866774


%chk=000297430-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297430

0 1
S 1.299987 -1.368708 -0.781027
O -1.996812 0.381519 0.876803
O 0.005567 -0.278894 1.898180
O 1.452370 -1.390729 -2.393801
O 1.232237 -2.743358 0.061889
N -0.329558 -0.398637 -0.461599
C -2.542743 0.405013 -0.547439
C -2.851507 1.878695 -0.890470
C -3.805403 -0.481160 -0.564537
C -3.987283 2.449895 -0.009839
C -4.934608 0.107717 0.313498
C -5.255977 1.568027 -0.083695
C -1.383385 -0.169563 -1.389711
C -0.689250 -0.127332 0.878261
C -1.405409 -0.379131 -2.728365
C 2.612972 -0.221119 -0.075155
C 3.217423 0.678847 -0.966968
C 2.971745 -0.357898 1.274523
C 4.245949 1.501105 -0.457485
C 4.007008 0.474709 1.750173
C 4.649996 1.416040 0.901783
C 5.735636 2.325817 1.444591
H -3.142515 1.917365 -1.958951
H -1.927545 2.476351 -0.783391
H -3.535706 -1.500633 -0.233291
H -4.144151 -0.560153 -1.616619
H -4.213408 3.484064 -0.332216
H -3.637461 2.502586 1.038707
H -4.618445 0.076827 1.373612
H -5.835472 -0.528102 0.221909
H -6.040334 1.976811 0.580991
H -5.664413 1.590708 -1.115882
H -0.552257 -0.792370 -3.267699
H -2.311107 -0.139536 -3.291840
H 2.914798 0.716476 -2.018079
H 2.460737 -1.074448 1.921888
H 4.742808 2.211778 -1.127264
H 4.313155 0.394127 2.799037
H 6.341827 1.818344 2.214947
H 6.413056 2.673716 0.646228
H 5.292180 3.223639 1.917003


