%chk=000240367.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240367

0 1
S -0.375516 -1.246795 1.163795
O -0.216894 -2.680070 1.335370
O -0.388627 -0.394305 2.331912
O -0.415670 1.918569 0.240804
O 1.523426 2.749859 0.717624
N 1.881052 -1.547285 -0.484347
N 2.543783 0.582309 -0.908736
N -1.698624 -0.932915 0.186571
N -3.581878 0.296932 -0.456715
N 0.807621 1.860085 0.325893
C 0.983216 -0.724877 0.170158
C 1.414442 0.587954 -0.103880
C 2.816535 -0.727352 -1.137522
C 1.879216 -3.010590 -0.534157
C -2.443994 0.159324 0.298348
C -3.966305 -0.686185 -1.491274
C -4.272199 1.604252 -0.507879
H 3.638846 -1.098849 -1.734567
H 2.899724 -3.413963 -0.418886
H 1.251721 -3.454651 0.286937
H 1.452302 -3.373308 -1.487716
H -2.238316 0.997632 1.009864
H -3.540844 -0.428364 -2.475669
H -5.062809 -0.746319 -1.573236
H -3.586112 -1.693707 -1.220421
H -3.923391 2.283137 0.290372
H -5.359339 1.460718 -0.373453
H -4.103565 2.112166 -1.474590


%chk=000240367-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240367

0 1
S -0.498314 -1.343068 0.961042
O -0.361331 -2.959648 1.033674
O -0.634541 -0.511552 2.355424
O -0.402967 1.724465 0.267215
O 1.333233 2.854021 -0.701774
N 2.100346 -1.621926 -0.302679
N 2.746048 0.458813 -0.975818
N -1.816131 -0.962199 -0.282450
N -3.717729 0.407279 -0.510955
N 0.778621 1.779889 -0.271462
C 1.063022 -0.751358 0.040788
C 1.494832 0.521642 -0.383636
C 3.085054 -0.840642 -0.911833
C 2.215980 -3.083935 -0.098336
C -2.627473 0.000357 0.187213
C -4.043618 -0.189219 -1.819186
C -4.526168 1.551678 -0.059685
H 4.014373 -1.264488 -1.284759
H 3.173080 -3.403805 -0.540513
H 2.194360 -3.328302 0.973873
H 1.377032 -3.606211 -0.579524
H -2.450409 0.498852 1.152892
H -3.785455 0.504570 -2.641810
H -5.123544 -0.416252 -1.867677
H -3.462286 -1.116228 -1.940225
H -4.194448 1.879480 0.938199
H -5.593260 1.267787 -0.005274
H -4.420507 2.403403 -0.758122


