%chk=000266802.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266802

0 1
S -0.041161 -1.618306 0.165962
O -0.799715 -1.575781 -1.075326
O 0.391233 -2.892609 0.701497
O -5.207570 0.531299 -0.565252
O -3.621673 2.089382 -0.317374
N -1.041438 -0.963368 1.412127
C 1.267214 -0.511675 0.063118
C -1.949561 0.150302 1.082127
C -3.120585 -0.263338 0.169090
C 2.306443 -0.561588 0.998947
C 1.301528 0.438727 -0.966220
C 3.403535 1.296951 -0.109676
C 3.370042 0.337713 0.916643
C 2.360070 1.339672 -1.053775
C 4.533748 2.264220 -0.211392
C -3.926966 0.921773 -0.238639
H -2.345907 0.579697 2.032420
H -1.368702 0.971610 0.596240
H -1.451219 -1.628624 2.079359
H -3.760846 -1.035706 0.644566
H -2.727645 -0.771640 -0.759887
H 2.292612 -1.312446 1.796741
H 0.496406 0.468783 -1.710945
H 4.174753 0.292116 1.648311
H 2.381725 2.076745 -1.854913
H 4.175338 3.305049 -0.211496
H 5.254381 2.174457 0.612823
H 5.097576 2.120795 -1.146441
H -5.773517 1.288291 -0.873538


%chk=000266802-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266802

0 1
S -0.095748 -1.427723 0.067140
O -0.844232 -1.274703 -1.381302
O 0.306620 -2.878268 0.689090
O -5.650238 0.067095 -0.448908
O -4.268257 1.913520 -0.174622
N -1.124545 -0.643427 1.421272
C 1.423222 -0.322996 0.014302
C -2.166413 0.303335 0.953944
C -3.399102 -0.355012 0.289668
C 2.407107 -0.505267 0.997468
C 1.527777 0.613592 -1.026469
C 3.709206 1.287673 -0.089311
C 3.555548 0.314651 0.933554
C 2.684626 1.421218 -1.064861
C 4.950129 2.158857 -0.155713
C -4.431588 0.673760 -0.116228
H -2.467891 0.888195 1.843699
H -1.703030 1.022361 0.256684
H -1.492465 -1.458983 1.948781
H -3.877188 -1.095919 0.957441
H -3.075350 -0.902547 -0.617614
H 2.288257 -1.267911 1.773346
H 0.742345 0.687407 -1.785621
H 4.341740 0.194825 1.687310
H 2.794153 2.161480 -1.865931
H 4.685431 3.231515 -0.190786
H 5.606183 1.999039 0.716099
H 5.540106 1.940282 -1.065657
H -6.296304 0.766455 -0.741680


