%chk=000215686.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215686

0 1
S -2.793624 -1.398020 -0.350212
O 4.785018 0.569469 -1.143641
N 1.815978 -0.309662 0.808010
N -2.441555 1.163060 0.042464
N -4.771063 0.488385 0.035308
C 1.013186 -1.561443 0.758484
C 1.027420 0.899619 1.174633
C 0.001659 -1.703647 -0.400701
C 0.034498 1.435355 0.126196
C -1.150518 -0.794457 -0.247224
C -1.161123 0.556727 -0.024633
C 2.667303 -0.108479 -0.400830
C 4.031785 0.414203 0.079402
C -3.409817 0.267857 -0.101786
H 0.476425 -1.654195 1.730319
H 1.734081 -2.409277 0.718138
H 1.759607 1.702766 1.418296
H 0.484519 0.674679 2.120862
H -0.322562 -2.764175 -0.459230
H 0.503832 -1.501781 -1.373958
H 0.535365 1.544658 -0.861822
H -0.281948 2.464028 0.410414
H 2.236090 0.600363 -1.142631
H 2.823077 -1.061239 -0.951714
H 4.540501 -0.304390 0.743340
H 3.959359 1.397376 0.574133
H 5.723011 0.733493 -0.941398
H -5.063823 1.461394 0.068998
H -5.390685 -0.096665 -0.509416


%chk=000215686-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215686

0 1
S -2.928067 -1.458015 -0.387654
O 4.963425 0.587241 -1.106508
N 1.806035 -0.290680 0.688176
N -2.521517 1.153429 0.043523
N -4.842158 0.581828 -0.136477
C 1.061640 -1.560347 0.716278
C 1.063766 0.912778 1.117929
C -0.042611 -1.757358 -0.371689
C -0.031026 1.447742 0.149785
C -1.216099 -0.818988 -0.217343
C -1.244059 0.550803 -0.003745
C 2.759277 -0.104361 -0.423623
C 4.125425 0.382062 0.089273
C -3.496939 0.278689 -0.137813
H 0.587988 -1.660662 1.712629
H 1.792229 -2.386976 0.613616
H 1.797164 1.725556 1.288407
H 0.594589 0.692277 2.096608
H -0.388401 -2.807498 -0.315406
H 0.416463 -1.637876 -1.376295
H 0.422389 1.642493 -0.844151
H -0.392288 2.423734 0.522116
H 2.404006 0.614682 -1.194397
H 2.912084 -1.067475 -0.944341
H 4.559905 -0.382482 0.765258
H 4.006012 1.328906 0.657743
H 5.863663 0.892770 -0.832689
H -5.113999 1.548722 0.024904
H -5.552902 -0.124991 -0.294316


