%chk=000241416.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241416

0 1
S 0.905715 0.800784 -1.263158
O -0.623232 0.517262 1.091141
O 4.916935 -1.233932 0.579541
O 3.337121 -1.170893 2.166952
N 3.239796 -0.152055 -1.357661
N 2.404904 0.376066 -2.112010
C -1.453366 -0.667059 0.901810
C -2.698310 -0.176047 0.215028
C 0.735644 0.238022 1.453187
C 1.544075 0.180110 0.213398
C -3.153182 1.133623 0.420367
C -3.415646 -1.046777 -0.618621
C 2.820607 -0.303307 -0.004005
C -4.321988 1.571203 -0.208510
C -4.587310 -0.604613 -1.238520
C -5.041376 0.703080 -1.035735
C 3.663679 -0.926381 1.021515
H -1.679881 -1.077452 1.904958
H -0.906213 -1.416788 0.304141
H 0.842758 -0.676915 2.074368
H 1.017241 1.116980 2.080823
H -2.583805 1.805984 1.064646
H -3.066577 -2.063632 -0.785927
H -4.672698 2.590205 -0.051606
H -5.146833 -1.280493 -1.883564
H -5.953334 1.044234 -1.522281
H 5.468978 -1.661009 1.297723


%chk=000241416-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241416

0 1
S 1.443074 0.525744 -1.776131
O -0.521676 0.756749 0.533545
O 4.874148 -1.471004 1.281684
O 3.055332 -0.693600 2.508286
N 3.800637 -0.626179 -1.089795
N 3.335362 -0.274952 -2.202383
C -1.304531 -0.471938 0.272192
C -2.740409 -0.081363 -0.014130
C 0.827802 0.488552 1.007564
C 1.802557 0.139397 -0.104115
C -3.347698 1.000030 0.671129
C -3.503654 -0.826654 -0.945986
C 3.075037 -0.451944 0.095548
C -4.701026 1.324584 0.430718
C -4.860844 -0.508349 -1.179421
C -5.463819 0.568906 -0.490688
C 3.626705 -0.862139 1.398586
H -1.242454 -1.123495 1.172834
H -0.875562 -1.029145 -0.586614
H 0.851581 -0.301842 1.784275
H 1.168102 1.423915 1.490302
H -2.747198 1.590186 1.370417
H -3.037958 -1.655022 -1.494835
H -5.160830 2.166501 0.960599
H -5.441508 -1.092380 -1.902186
H -6.514147 0.821133 -0.674776
H 5.196677 -1.715492 2.191378


