%chk=000277874.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277874

0 1
S -2.678749 -1.901294 0.416140
O -3.688057 -2.700069 -0.253758
O -2.391705 -2.140881 1.805540
O 5.436407 1.266444 0.787130
N -1.263196 -2.295666 -0.533558
N -0.156597 -1.584550 -0.198419
C -2.950125 -0.235114 0.126310
C -3.423822 2.489585 -0.341081
C -3.990660 0.162159 -0.724308
C -2.144522 0.732879 0.738691
C -4.229752 1.514583 -0.957842
C -2.378333 2.088708 0.508136
C -3.667283 3.938044 -0.600435
C 2.170392 -1.036517 -0.352807
C 3.199381 -0.841449 -1.285932
C 2.273127 -0.456782 0.929864
C 1.005181 -1.856234 -0.731007
C 4.401473 0.489794 0.315280
C 4.323737 -0.076257 -0.962922
C 3.381312 0.305541 1.272875
C 6.554810 1.515426 -0.097720
H -4.622831 -0.594813 -1.205378
H -1.324749 0.428105 1.400087
H -5.040419 1.816066 -1.618302
H -1.746092 2.835042 0.985903
H -1.222943 -3.122116 -1.145771
H -3.068998 4.284315 -1.458432
H -4.718916 4.154817 -0.834674
H -3.393688 4.570847 0.255804
H 3.126998 -1.284691 -2.279159
H 1.472806 -0.615029 1.656810
H 1.207545 -2.654608 -1.457138
H 5.108995 0.066359 -1.696695
H 3.482296 0.758265 2.256767
H 6.224401 2.066601 -0.982543
H 7.048170 0.575574 -0.361189
H 7.204705 2.136712 0.532635


%chk=000277874-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277874

0 1
S -2.513782 -1.822025 0.330963
O -3.567710 -2.879123 -0.320586
O -1.939753 -1.994851 1.844024
O 5.957089 1.233239 0.567884
N -1.081234 -1.834394 -1.002609
N 0.040708 -1.184752 -0.557016
C -3.157446 -0.072342 0.140954
C -4.157964 2.526855 -0.105569
C -4.076024 0.187797 -0.887625
C -2.717686 0.895050 1.057008
C -4.575077 1.503685 -0.998735
C -3.233116 2.202703 0.922376
C -4.678774 3.944174 -0.257267
C 2.448887 -0.842254 -0.592748
C 3.709420 -1.287096 -1.072662
C 2.411852 0.300348 0.264042
C 1.237011 -1.565214 -0.974570
C 4.845576 0.497981 0.141004
C 4.905404 -0.631114 -0.714069
C 3.591040 0.960536 0.627120
C 7.279858 0.797232 0.110053
H -4.401812 -0.612018 -1.559999
H -2.016327 0.625331 1.852541
H -5.299190 1.737637 -1.787390
H -2.912985 2.980245 1.625344
H -0.999714 -2.840208 -1.289850
H -4.007978 4.540403 -0.905800
H -5.681457 3.961486 -0.718079
H -4.738079 4.461409 0.715966
H 3.757289 -2.161051 -1.734414
H 1.440854 0.646518 0.631238
H 1.361813 -2.431419 -1.655306
H 5.860216 -1.000732 -1.098938
H 3.578414 1.835141 1.284508
H 7.359304 0.846692 -0.993139
H 7.503928 -0.230709 0.454689
H 7.987745 1.504635 0.565559


