%chk=000217619.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217619

0 1
S -3.364503 1.025334 0.340703
O 0.303441 -2.354706 0.560527
N 2.369297 -0.086482 0.015776
N -0.787137 1.598270 0.023215
N 1.663700 2.071499 -0.267422
N -1.335339 -0.724709 0.442826
C 0.978609 -0.103316 0.140422
C 0.570337 1.249630 -0.040116
C 2.748189 1.229820 -0.227994
C 0.023055 -1.189707 0.398301
C 3.224422 -1.268947 0.129135
C -1.667762 0.530839 0.271120
C -4.239112 -0.511478 0.662766
H -1.075921 2.566508 -0.106153
H 3.769482 1.557484 -0.369908
H 2.938807 -2.028620 -0.628631
H 4.288239 -1.016206 -0.002184
H 3.088947 -1.752323 1.119573
H -3.912167 -0.979403 1.604974
H -4.067073 -1.255101 -0.131534
H -5.312311 -0.290685 0.723504


%chk=000217619-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217619

0 1
S -3.420412 1.113203 0.333922
O 0.294360 -2.408241 0.571726
N 2.352283 -0.104949 0.019991
N -0.765994 1.584827 0.024633
N 1.658328 2.062546 -0.265980
N -1.359218 -0.712839 0.443983
C 0.952549 -0.114573 0.145480
C 0.575438 1.230769 -0.036956
C 2.718141 1.210419 -0.223336
C -0.002333 -1.187481 0.401993
C 3.240490 -1.274487 0.128419
C -1.676690 0.553131 0.269364
C -4.244811 -0.538883 0.666524
H -1.055831 2.557015 -0.105666
H 3.753336 1.512317 -0.363668
H 2.979336 -2.023047 -0.635883
H 4.281882 -0.943653 -0.014871
H 3.131976 -1.744307 1.118448
H -3.864125 -0.952463 1.609873
H -4.020805 -1.229872 -0.157046
H -5.322701 -0.321731 0.727950


