%chk=000196353.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196353

0 1
S -1.831812 -2.109068 -0.460080
O 0.117641 2.435640 -0.526458
O -5.519252 0.988394 0.386061
N -0.712576 0.287445 -0.653121
N 0.844675 -1.624926 -0.457344
N 3.110360 -1.272065 0.132826
N 4.057070 0.964350 -0.003506
C -0.406144 -1.107495 -1.055167
C -2.002190 0.452991 -0.031080
C -2.688166 -0.700353 0.154974
C 0.364761 1.250674 -0.540293
C -4.019511 -0.910378 0.764528
C 1.694638 0.655376 -0.408571
C 1.881570 -0.747965 -0.235875
C -2.450198 1.813521 0.336187
C -5.154550 -0.316871 -0.088267
C 2.848095 1.469878 -0.308459
C 4.149361 -0.401817 0.238499
C 5.480909 -0.936122 0.628877
H -0.319564 -1.167219 -2.177154
H 0.908874 -2.601685 -0.160745
H -4.038887 -0.445727 1.777833
H -4.211348 -1.990072 0.943379
H -2.012587 2.148468 1.288738
H -3.553962 1.865658 0.430851
H -2.156293 2.570583 -0.415411
H -6.048075 -0.963520 -0.091028
H -4.840429 -0.115389 -1.131595
H 2.774568 2.558011 -0.468223
H 6.237286 -0.713278 -0.143311
H 5.838315 -0.462105 1.559206
H 5.465632 -2.026814 0.786691
H -5.942111 0.932681 1.264539


%chk=000196353-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000196353

0 1
S -1.649631 -1.884460 0.513641
O 0.201078 2.289727 1.218187
O -5.100910 -0.254671 -1.287770
N -0.656300 0.577793 -0.150236
N 0.808421 -1.176301 -0.968141
N 3.128938 -1.145776 -0.592142
N 4.147818 0.656262 0.701381
C -0.527458 -0.744878 -0.740897
C -2.055174 0.796377 0.214649
C -2.688807 -0.354946 0.605726
C 0.398791 1.248916 0.525823
C -4.126289 -0.524994 1.016609
C 1.737842 0.646197 0.330429
C 1.907500 -0.564481 -0.397457
C -2.618819 2.187940 0.112077
C -5.013362 -1.123248 -0.107406
C 2.913799 1.213118 0.868147
C 4.204239 -0.508598 -0.035009
C 5.563400 -1.124426 -0.230433
H -1.149465 -0.821878 -1.646008
H 0.976469 -2.024153 -1.513349
H -4.549723 0.444519 1.343491
H -4.180926 -1.206134 1.889769
H -2.005005 2.890808 0.700192
H -3.657234 2.222840 0.478858
H -2.613960 2.533580 -0.939131
H -6.022276 -1.344075 0.301479
H -4.566442 -2.057384 -0.483422
H 2.849879 2.140000 1.447453
H 6.243991 -0.397516 -0.708267
H 6.008404 -1.376845 0.748869
H 5.491271 -2.031002 -0.848492
H -5.533958 0.598491 -1.031119


