%chk=000239955.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239955

0 1
O 3.071964 1.372077 0.559727
O 2.713182 -2.076743 0.525758
O 2.778200 -0.805907 -1.321002
N -1.975044 -0.075316 -0.208285
N -3.822249 -1.437240 0.357374
N -4.216551 0.896609 -0.046650
C 0.783110 0.528665 0.890886
C 0.226005 0.949588 -0.472324
C 2.285341 0.234051 0.881004
C -1.289845 1.212739 -0.408683
C 2.613375 -0.874901 -0.127785
C -3.263109 -0.164623 -0.032659
H 0.587247 1.322514 1.641310
H 0.228864 -0.367293 1.251969
H 0.429599 0.160384 -1.228918
H 0.736093 1.863643 -0.831836
H 2.659239 -0.043978 1.900052
H -1.613931 1.697285 -1.357763
H -1.521790 1.930037 0.412197
H 2.844666 1.716265 -0.338124
H 2.914437 -2.836374 -0.084329
H -3.105413 -2.117428 0.614144
H -4.436527 -1.842185 -0.341597
H -5.184634 0.655146 0.114516
H -4.098830 1.604387 -0.755383


%chk=000239955-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239955

0 1
O 2.958281 1.564426 0.633279
O 2.348847 -2.042869 0.385568
O 3.387449 -0.556034 -1.068757
N -1.955470 -0.211436 -0.296298
N -3.824035 -1.476130 0.366046
N -4.162883 0.795464 -0.123882
C 0.711176 0.495778 0.846980
C 0.209903 0.947178 -0.538577
C 2.250747 0.320268 0.932675
C -1.325441 1.098867 -0.561436
C 2.732727 -0.771338 -0.019779
C -3.242899 -0.264762 -0.046290
H 0.435814 1.254242 1.605139
H 0.215057 -0.453011 1.121853
H 0.490201 0.203904 -1.310180
H 0.680486 1.912033 -0.809622
H 2.522961 0.031168 1.964385
H -1.620972 1.491497 -1.562324
H -1.623234 1.871485 0.190764
H 3.314947 1.496168 -0.293988
H 2.646103 -2.715758 -0.285471
H -3.163972 -2.244656 0.476504
H -4.765818 -1.707762 0.051975
H -5.022392 0.769476 0.420357
H -3.854186 1.693204 -0.485322


