%chk=000256027.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256027

0 1
S 0.006783 1.828641 -0.009742
O -1.244769 2.555935 0.026280
O 1.263877 2.545936 -0.052461
O -1.770269 0.506747 -2.977186
O 1.773772 0.520568 2.969779
C -0.016057 0.744593 -1.400535
C 0.021311 0.757369 1.391032
C -1.392680 0.317954 -1.849580
C 1.394604 0.324213 1.843993
C -2.215489 -0.387718 -0.814647
C 2.211803 -0.397478 0.815680
C -2.058906 -1.766844 -0.624936
C 2.044591 -1.777030 0.638829
C -3.167127 0.329279 -0.078932
C 3.168915 0.305286 0.073293
C -2.852367 -2.427863 0.316013
C 2.832928 -2.452915 -0.295893
C -3.957877 -0.339141 0.860767
C 3.954430 -0.377928 -0.860088
C -3.801533 -1.714566 1.057798
C 3.787508 -1.753924 -1.044258
H 0.617331 -0.156484 -1.242936
H 0.498239 1.235053 -2.266523
H -0.619127 -0.140138 1.241827
H -0.489078 1.259834 2.252448
H -1.334416 -2.324762 -1.216924
H 1.315854 -2.323845 1.235942
H -3.276635 1.411535 -0.229728
H 3.286746 1.388030 0.214006
H -2.740170 -3.501004 0.464755
H 2.712461 -3.526510 -0.434548
H -4.700910 0.215680 1.434138
H 4.701685 0.165745 -1.438626
H -4.423528 -2.234278 1.786852
H 4.405500 -2.285168 -1.768387


%chk=000256027-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256027

0 1
S 0.006264 2.238554 -0.006996
O -1.320417 3.035758 0.493230
O 1.333540 3.031804 -0.511673
O -2.699868 1.649805 -2.208514
O 2.718692 1.650696 2.185815
C -0.487416 1.022952 -1.543843
C 0.498967 1.032351 1.537781
C -1.988024 0.831229 -1.555617
C 1.998106 0.830259 1.544944
C -2.604198 -0.269500 -0.748660
C 2.602975 -0.283368 0.747027
C -1.903647 -1.456605 -0.400559
C 1.892894 -1.469571 0.415507
C -3.959726 -0.118735 -0.346743
C 3.957503 -0.146136 0.337009
C -2.547177 -2.471704 0.340110
C 2.526122 -2.497056 -0.316934
C -4.594517 -1.125272 0.406093
C 4.581948 -1.165090 -0.407750
C -3.889866 -2.304257 0.752434
C 3.867846 -2.343092 -0.737633
H 0.149227 0.142824 -1.375248
H -0.139397 1.644199 -2.382474
H -0.144693 0.155488 1.379153
H 0.158762 1.663227 2.372439
H -0.878310 -1.619064 -0.751487
H 0.868173 -1.621202 0.773073
H -4.485236 0.798224 -0.631671
H 4.490582 0.770254 0.609464
H -2.010378 -3.394113 0.587320
H 1.982031 -3.418551 -0.551271
H -5.634412 -0.996068 0.723798
H 5.621138 -1.046334 -0.731775
H -4.385937 -3.089299 1.333533
H 4.355849 -3.137804 -1.312380


