%chk=000294294.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294294

0 1
S -2.877437 1.471955 1.737538
O 4.221460 -2.807563 -0.401927
N -1.018705 0.205580 -0.390104
N 2.445855 -2.339951 1.020136
N 3.298285 -0.699839 -0.632734
C -0.087973 -0.879614 -0.811731
C 0.050381 -1.972714 0.261662
C -0.490509 1.292251 0.368305
C -2.416433 -0.023115 -0.532920
C 1.147439 -1.668294 1.292282
C -1.271445 2.005734 1.296460
C -3.367097 0.570511 0.321268
C 0.841878 1.712676 0.152594
C -2.887339 -0.827644 -1.596208
C -0.770681 3.129125 1.956021
C -4.735323 0.407680 0.110315
C 3.239824 -1.860614 -0.020816
C 1.345543 2.819482 0.830853
C -4.256259 -1.005418 -1.790128
C 0.544556 3.537978 1.727412
C -5.185856 -0.389297 -0.946034
C 5.092220 -2.131226 -1.371151
C 4.473743 -0.718813 -1.539834
H -0.459437 -1.324755 -1.764102
H 0.909478 -0.432117 -1.057033
H -0.919382 -2.101222 0.788777
H 0.234952 -2.946465 -0.231400
H 1.324649 -0.566727 1.372183
H 0.829771 -2.002184 2.307440
H 1.489492 1.165772 -0.542774
H -2.180180 -1.300596 -2.276829
H 2.430465 -3.361385 1.100533
H -1.400176 3.683529 2.654386
H -5.456422 0.893765 0.770542
H 2.376936 3.128199 0.656690
H -4.603651 -1.628156 -2.614671
H 0.944478 4.406954 2.243251
H -6.251419 -0.526691 -1.109924
H 5.058867 -2.753719 -2.275804
H 6.094470 -2.133839 -0.919561
H 5.177340 0.089119 -1.252367
H 4.145844 -0.516851 -2.579099


%chk=000294294-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294294

0 1
S -2.207743 1.154481 2.235984
O 4.322262 -2.834645 0.286765
N -0.892390 0.181316 -0.351921
N 2.006272 -2.882011 0.571449
N 3.081919 -1.012399 -0.524710
C -0.048799 -0.691432 -1.207089
C -0.076059 -2.162674 -0.723169
C -0.370946 1.429790 0.118003
C -2.301156 -0.053493 -0.303277
C 0.632301 -2.348317 0.649835
C -0.919177 2.047108 1.277144
C -3.073724 0.397555 0.804390
C 0.685938 2.103418 -0.553086
C -2.982480 -0.734621 -1.350187
C -0.447017 3.290024 1.741650
C -4.468007 0.206075 0.854204
C 3.070399 -2.176814 0.081706
C 1.187419 3.329244 -0.065543
C -4.374397 -0.961327 -1.283705
C 0.624020 3.933483 1.080228
C -5.127387 -0.489738 -0.185947
C 5.333732 -1.945729 -0.366155
C 4.516061 -0.670501 -0.776734
H -0.350081 -0.627503 -2.273980
H 0.997932 -0.354673 -1.128846
H -1.120783 -2.516262 -0.648680
H 0.426175 -2.795341 -1.479130
H 0.639491 -1.377898 1.182905
H 0.062888 -3.056307 1.276995
H 1.122883 1.669111 -1.456042
H -2.424854 -1.083601 -2.223952
H 2.213540 -3.799833 0.960844
H -0.906673 3.741846 2.627177
H -5.031045 0.585945 1.713468
H 2.012590 3.817777 -0.595445
H -4.869434 -1.497978 -2.100681
H 1.004973 4.889540 1.453608
H -6.208109 -0.656992 -0.135482
H 5.750378 -2.491913 -1.230047
H 6.125111 -1.747932 0.374211
H 4.801500 0.211792 -0.173666
H 4.664679 -0.417068 -1.841593


