%chk=000267384.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267384

0 1
S 2.601537 -2.002693 0.341247
O 2.694432 -2.911608 -0.777122
O 3.513158 -2.105064 1.461703
O -0.314237 -0.102767 1.810337
N 1.039959 -2.286569 1.112023
N -0.018386 -1.791719 0.315350
N -2.565162 1.302240 1.847658
C 2.576422 -0.383829 -0.242601
C 2.831023 0.683391 0.626523
C 2.310539 -0.131499 -1.593730
C -1.979993 -0.288179 0.099848
C 2.544522 2.250824 -1.202943
C -2.869786 0.687400 0.658592
C 2.815861 1.995030 0.152499
C 2.292222 1.176789 -2.075126
C -0.769454 -0.682775 0.821070
C -2.295527 -0.839317 -1.164858
C -4.076830 1.007707 -0.046342
C 2.509579 3.652868 -1.712006
C -3.450549 -0.500835 -1.841464
C -4.349811 0.423958 -1.262745
C -3.454776 2.274378 2.507422
H 3.048859 0.492567 1.683290
H 2.122135 -0.966960 -2.278442
H 0.967451 -1.988826 2.110848
H 3.011848 2.819272 0.835254
H 2.082818 1.365525 -3.125912
H -0.535921 -2.578231 -0.110616
H -1.602562 -1.547742 -1.626640
H -4.774879 1.721148 0.381306
H 1.481964 4.048797 -1.684666
H 3.132340 4.334856 -1.116684
H 2.855546 3.729937 -2.752386
H -1.672431 1.093024 2.326707
H -3.675874 -0.935236 -2.810859
H -5.268085 0.675207 -1.797457
H -3.613810 3.170740 1.880799
H -3.001666 2.604145 3.458321
H -4.440775 1.832847 2.740203


%chk=000267384-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267384

0 1
S 1.920202 -1.402675 -0.177823
O 0.568223 -1.381320 -1.140278
O 3.085154 -2.525882 -0.446231
O -0.899877 0.524670 1.400788
N 0.700447 -1.678667 1.812321
N -0.541356 -1.749513 1.274131
N -3.383302 1.417231 0.923224
C 2.764689 0.285159 -0.372745
C 4.152571 0.297212 -0.584814
C 1.983773 1.450672 -0.303926
C -2.593401 -0.810772 0.243946
C 4.041532 2.760116 -0.691620
C -3.617791 0.219096 0.285633
C 4.782894 1.550601 -0.749653
C 2.639537 2.690771 -0.470006
C -1.333234 -0.602486 0.954701
C -2.834420 -2.001983 -0.505084
C -4.875819 -0.052941 -0.345527
C 4.735374 4.102148 -0.841756
C -4.062433 -2.233772 -1.137362
C -5.089410 -1.254493 -1.033147
C -4.381664 2.473855 1.072246
H 4.705982 -0.646410 -0.636435
H 0.902573 1.398444 -0.132578
H 0.806770 -0.677503 2.128545
H 5.863928 1.587223 -0.928228
H 2.052955 3.616048 -0.428388
H -0.829609 -2.679362 0.965083
H -2.021551 -2.722496 -0.651356
H -5.670894 0.696785 -0.306166
H 5.031931 4.506004 0.145790
H 5.652135 4.018038 -1.450614
H 4.075291 4.849170 -1.316297
H -2.422360 1.551484 1.273223
H -4.221621 -3.143891 -1.722621
H -6.056849 -1.429582 -1.517581
H -4.710672 2.877044 0.093261
H -3.938874 3.301317 1.649164
H -5.279123 2.119460 1.616579


