%chk=000246059.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246059

0 1
O -1.402665 0.957066 -0.491804
O -2.149789 -0.319328 1.284158
O 2.567255 1.555542 -0.988956
O 1.348174 2.121399 0.828386
C -2.846296 0.902396 -0.623439
C -3.275258 -0.206726 0.371581
C -0.991704 0.339150 0.742408
C 0.115684 -0.645026 0.415683
C -3.423370 2.267358 -0.292134
C -3.528073 -1.548703 -0.292137
C 1.394537 -0.186664 0.050562
C -0.124679 -2.022247 0.482610
C 2.402006 -1.102990 -0.286256
C 0.885963 -2.933415 0.164629
C 2.147225 -2.475085 -0.229019
C 1.710294 1.266362 0.052304
C 2.972194 2.944789 -1.122280
H -2.995613 0.632345 -1.690213
H -4.111927 0.090206 1.039493
H -0.696887 1.125743 1.471736
H -3.265153 2.533969 0.761559
H -2.921522 3.048118 -0.882276
H -4.495750 2.323356 -0.502099
H -3.632012 -2.340559 0.462233
H -4.444920 -1.538990 -0.891364
H -2.698322 -1.841906 -0.949942
H -1.111211 -2.372326 0.799298
H 3.383027 -0.734361 -0.594821
H 0.688982 -4.003783 0.222634
H 2.931250 -3.184953 -0.488442
H 2.091488 3.559751 -1.334408
H 3.662090 2.910211 -1.971410
H 3.463682 3.277503 -0.202773


%chk=000246059-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246059

0 1
O -1.510391 0.418850 -1.009170
O -2.058625 -0.859500 0.869117
O 2.957054 1.701073 -0.512819
O 0.935483 2.123157 0.542313
C -2.988607 0.551295 -0.847327
C -3.300369 -0.115680 0.536985
C -0.994480 -0.018081 0.320305
C 0.280051 -0.813694 0.120501
C -3.416996 2.019849 -0.936405
C -4.471376 -1.093342 0.543080
C 1.551294 -0.188942 -0.067514
C 0.191664 -2.223343 0.056794
C 2.693131 -0.995853 -0.326804
C 1.333312 -3.015354 -0.186715
C 2.589735 -2.398713 -0.384755
C 1.729761 1.293966 0.030877
C 3.230972 3.153689 -0.432942
H -3.434641 -0.041040 -1.668679
H -3.444652 0.680689 1.299811
H -0.847116 0.875978 0.953934
H -2.912273 2.621003 -0.159182
H -3.152322 2.440261 -1.921297
H -4.512048 2.115761 -0.802366
H -4.583445 -1.559285 1.537046
H -5.413325 -0.568243 0.300520
H -4.310484 -1.891965 -0.202239
H -0.789294 -2.681711 0.207070
H 3.656317 -0.502723 -0.478326
H 1.242420 -4.106550 -0.225516
H 3.480795 -3.005033 -0.579640
H 2.450954 3.718728 -0.970231
H 4.212807 3.279584 -0.910523
H 3.253393 3.483369 0.619598


