%chk=000287441.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287441

0 1
S 1.580319 -1.317597 0.064474
S 3.657784 0.555327 -1.127339
O -1.822672 -3.406463 -0.342319
O 0.311165 -3.031847 -0.132609
O -3.824971 2.595708 -0.183058
O -4.749702 0.646616 -0.372629
N -0.872274 -2.662472 -0.218153
N -3.784109 1.379159 -0.248218
C 0.085521 -0.415444 -0.014643
C -1.069053 -1.217443 -0.157267
C -2.453866 0.741160 -0.169063
C -2.350051 -0.647748 -0.236619
C -0.047082 0.981939 0.051992
C -1.304472 1.558866 -0.025314
C 2.780049 -0.072577 0.234112
C 3.267935 0.450030 1.395427
C 4.357896 1.373471 1.185409
C 4.682734 1.536078 -0.128978
H -3.242441 -1.284662 -0.348561
H 0.839607 1.614819 0.162686
H -1.432177 2.649240 0.022895
H 2.903800 0.216274 2.389058
H 4.850128 1.869094 2.012144
H 5.452532 2.159371 -0.553525


%chk=000287441-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287441

0 1
S 1.731863 -1.454490 0.204934
S 3.539393 0.739699 -1.187240
O -2.258091 -3.379390 -0.516445
O -0.025692 -3.426534 -0.048925
O -3.673542 2.725982 -0.226030
O -4.740205 0.726026 -0.511582
N -1.140986 -2.796644 -0.248403
N -3.682087 1.437456 -0.317270
C 0.105114 -0.603517 0.054347
C -1.112737 -1.321110 -0.156109
C -2.384337 0.733962 -0.189503
C -2.354082 -0.663552 -0.282987
C 0.018266 0.812094 0.145125
C -1.204888 1.484438 0.027727
C 2.855817 -0.029499 0.304895
C 3.429872 0.503207 1.452751
C 4.398217 1.537560 1.184390
C 4.571963 1.790593 -0.168549
H -3.265620 -1.243626 -0.448931
H 0.933361 1.385610 0.315772
H -1.266478 2.573292 0.101164
H 3.164307 0.158938 2.455005
H 4.944719 2.070240 1.965862
H 5.232455 2.510165 -0.650097


