%chk=000240373.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240373

0 1
S 1.026266 0.974577 1.404091
O 0.592638 2.352958 1.234338
O 1.701342 0.551170 2.620519
O -1.929092 -2.188567 1.309125
N 2.696856 -0.594814 -0.124509
N -0.337846 -0.068883 1.398860
N 2.988642 0.654970 -1.999871
N 1.516889 2.533485 -1.459697
C 1.930131 0.575077 0.050277
C 2.125893 1.336791 -1.136781
C -1.373284 -0.075934 0.434324
C 3.306908 -0.516041 -1.357109
C 2.797562 -1.673408 0.859527
C -2.244841 -1.211705 0.374278
C -1.587563 0.968632 -0.469610
C -3.269375 -1.292489 -0.560629
C -2.616872 0.879314 -1.419155
C -3.447904 -0.235383 -1.468135
C -2.942829 -3.183436 1.585999
H -0.474538 -0.732994 2.178462
H 3.960990 -1.272168 -1.773702
H 1.901081 -2.323731 0.828103
H 3.689254 -2.296923 0.681261
H 2.875329 -1.259510 1.894602
H -0.975828 1.873395 -0.432386
H -3.924230 -2.157324 -0.605235
H 1.136035 3.091911 -0.690215
H 1.892277 3.056313 -2.239597
H -2.761404 1.701400 -2.118978
H -4.243472 -0.295955 -2.207638
H -3.075655 -3.834006 0.716743
H -3.880976 -2.705635 1.882924
H -2.497486 -3.732986 2.424817


%chk=000240373-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240373

0 1
S 0.981516 0.029511 1.591592
O -0.025948 1.295928 1.928096
O 1.890680 -0.652097 2.770295
O -2.498732 -1.747463 1.761898
N 2.974343 -0.130348 -0.427677
N 0.048850 -1.624431 0.713753
N 2.809144 1.871052 -1.511736
N 1.027116 2.906358 -0.221071
C 1.967267 0.624131 0.217897
C 1.869319 1.859092 -0.472015
C -1.062598 -1.248125 -0.069252
C 3.441026 0.672048 -1.445340
C 3.442449 -1.471126 -0.041019
C -2.405799 -1.296506 0.444460
C -0.858914 -0.801549 -1.403728
C -3.499344 -0.924732 -0.366843
C -1.947929 -0.415049 -2.208757
C -3.263129 -0.479604 -1.688849
C -3.815757 -1.738688 2.407650
H -0.257959 -2.094529 1.592932
H 4.242354 0.360931 -2.112040
H 2.587246 -2.167463 -0.010135
H 4.176559 -1.815109 -0.786754
H 3.909686 -1.442431 0.957533
H 0.166325 -0.779005 -1.787581
H -4.523224 -0.964628 0.016660
H 0.362586 2.817382 0.552556
H 1.091876 3.742445 -0.794436
H -1.777204 -0.072688 -3.234075
H -4.113554 -0.185687 -2.313865
H -4.510815 -2.433971 1.899588
H -4.240008 -0.717443 2.418398
H -3.632529 -2.078104 3.436869


