%chk=000287261.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287261

0 1
S 0.082369 0.026414 1.053299
O -0.418813 -1.297976 1.308444
O 0.115708 1.025403 2.099994
N -0.891430 0.784524 -0.187492
N -4.212171 0.517808 0.951226
N -2.652110 -2.073785 -1.282819
C 1.612617 -0.090099 0.263354
C -1.968492 1.685517 0.271127
C -1.140060 0.059909 -1.446744
C 2.409324 1.048117 0.103733
C 2.065110 -1.336156 -0.186958
C 3.654827 0.944253 -0.523250
C 3.309316 -1.440408 -0.813224
C 4.102910 -0.299345 -0.981612
C -3.216035 1.015985 0.649716
C -1.988541 -1.131530 -1.332717
H -2.186187 2.438952 -0.530576
H -1.581813 2.273996 1.156448
H -0.147782 -0.235846 -1.883410
H -1.602909 0.758437 -2.195086
H 2.066266 2.019556 0.474707
H 1.448705 -2.232610 -0.039842
H 4.277538 1.829654 -0.647974
H 3.664035 -2.409825 -1.163041
H 5.076417 -0.381343 -1.468503


%chk=000287261-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287261

0 1
S 0.067636 -0.049484 1.072135
O -0.406651 -1.581837 1.334700
O 0.078232 1.068706 2.255636
N -0.953437 0.822742 -0.302815
N -4.411829 0.759955 0.831144
N -3.067421 -2.021822 -1.208113
C 1.746839 -0.107706 0.213866
C -1.982444 1.724425 0.255537
C -1.267622 -0.052043 -1.450107
C 2.484632 1.082920 0.110536
C 2.196043 -1.361017 -0.232894
C 3.754940 1.006175 -0.504852
C 3.469913 -1.412871 -0.846858
C 4.240513 -0.234745 -0.984302
C -3.319478 1.159271 0.566398
C -2.274490 -1.133865 -1.276560
H -2.112188 2.559983 -0.459759
H -1.555125 2.150555 1.186413
H -0.322243 -0.512556 -1.794872
H -1.610501 0.609182 -2.270267
H 2.092534 2.024917 0.505927
H 1.583671 -2.256832 -0.083640
H 4.363270 1.910830 -0.603811
H 3.856986 -2.371120 -1.207441
H 5.227021 -0.284161 -1.457201


