%chk=000252847.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252847

0 1
S -2.468955 -2.221710 -0.071704
O 2.477381 -0.035837 -0.780228
O -4.453196 -0.510834 -0.331660
O 1.889258 -0.074724 1.414130
N 0.117120 3.259006 0.210707
C -0.887297 -0.082275 0.273211
C -2.222512 0.464684 -0.256736
C 0.312574 0.709046 -0.315838
C -0.771605 -1.572669 -0.066724
C -3.270506 -0.610872 -0.241859
C 1.621583 0.164037 0.265609
C 0.209817 2.130568 -0.013666
C 3.821579 -0.555575 -0.492336
C 3.749931 -2.034892 -0.188900
H -0.865766 0.037731 1.391183
H -2.131693 0.858138 -1.293795
H -2.563270 1.337153 0.344748
H 0.337944 0.581460 -1.440480
H -0.305181 -1.757680 -1.052237
H -0.171156 -2.121159 0.684800
H 4.331690 -0.324622 -1.446463
H 4.249766 0.034049 0.337696
H 4.753168 -2.475808 -0.117011
H 3.243813 -2.225806 0.769703
H 3.203914 -2.586009 -0.965249


%chk=000252847-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252847

0 1
S -2.931378 -2.060780 0.482564
O 2.640255 0.058178 -0.612274
O -4.686003 0.034958 0.088465
O 1.605331 -0.710847 1.336499
N 0.387582 3.110591 -0.307341
C -1.011477 -0.101633 0.247154
C -2.291138 0.538643 -0.329716
C 0.281613 0.444561 -0.426513
C -1.136699 -1.635611 0.066620
C -3.498071 -0.322452 0.060641
C 1.560714 -0.144203 0.224485
C 0.349722 1.919906 -0.365351
C 3.983467 -0.411484 -0.121954
C 4.208450 -1.876811 -0.497945
H -0.954275 0.110127 1.330483
H -2.256476 0.569620 -1.439185
H -2.459928 1.570356 0.021083
H 0.300406 0.159809 -1.498013
H -0.943544 -1.948796 -0.974508
H -0.484355 -2.186969 0.757609
H 4.685970 0.265778 -0.631361
H 4.024656 -0.257566 0.970171
H 5.232321 -2.176548 -0.208060
H 3.498517 -2.535945 0.029208
H 4.102741 -2.027482 -1.585861


