%chk=000250738.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250738

0 1
S 1.967615 2.062076 0.457600
O -2.753670 -1.093203 -0.588164
O -0.798179 3.056582 -0.109402
O 1.137519 -3.489288 1.056569
O 4.153904 -0.985197 0.262004
N -0.476056 -1.015048 -0.305163
N -1.812456 1.018128 -0.353739
N 1.909361 -0.919520 0.105542
C 0.680902 -0.257538 -0.034850
C 0.581505 1.114517 0.038871
C -0.442973 -2.491947 -0.500682
C -1.782296 -0.380848 -0.415850
C -0.639311 1.858770 -0.133225
C -3.162686 1.673805 -0.433707
C 3.236115 1.138701 -0.440009
C -0.259769 -3.253199 0.820080
C 3.201318 -0.284895 0.011588
C -3.864302 1.654128 0.917599
H 0.362727 -2.751962 -1.224468
H -1.411356 -2.797171 -0.982281
H -3.002642 2.723250 -0.782015
H -3.768473 1.142773 -1.203097
H 1.915188 -1.922407 0.424604
H 4.224285 1.600424 -0.214342
H 3.108584 1.219952 -1.539859
H -0.809198 -4.210548 0.821431
H -0.569382 -2.658993 1.705105
H -4.056249 0.629657 1.262853
H -3.273675 2.161875 1.691629
H -4.832823 2.166558 0.860287
H 1.453773 -4.268132 0.550692


%chk=000250738-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250738

0 1
S 2.060994 2.233865 0.252864
O -2.759577 -1.153298 -0.571483
O -0.857802 3.110523 -0.040687
O 1.013578 -3.239512 1.138491
O 4.201272 -1.005964 0.390251
N -0.434243 -0.980877 -0.358803
N -1.814185 0.978534 -0.303054
N 1.900155 -0.881568 0.133033
C 0.705279 -0.190876 -0.106232
C 0.601326 1.191466 -0.061668
C -0.344737 -2.426947 -0.690150
C -1.741194 -0.415421 -0.412586
C -0.686111 1.859383 -0.143639
C -3.171335 1.595676 -0.330420
C 3.281902 1.051396 -0.584106
C -0.324385 -3.360771 0.524126
C 3.192664 -0.342512 0.025509
C -3.807364 1.647486 1.071626
H 0.555060 -2.599143 -1.306443
H -1.242111 -2.661769 -1.285692
H -3.040220 2.613056 -0.732524
H -3.790203 0.995572 -1.016674
H 1.815781 -1.842250 0.546868
H 4.289524 1.451724 -0.408102
H 3.062439 1.031644 -1.665786
H -0.485051 -4.400938 0.178713
H -1.120901 -3.080657 1.238783
H -3.934959 0.631640 1.483654
H -3.187407 2.245528 1.761160
H -4.804248 2.120120 1.009818
H 1.083361 -3.733810 1.988756


