%chk=000288753.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288753

0 1
O -0.262048 1.536571 0.376368
N 1.342077 -0.134118 -1.433939
N 1.290157 -0.890207 0.962932
C 0.681434 -1.035413 -0.414318
C 2.833995 -0.259969 -1.436988
C 2.782314 -1.012722 0.952296
C 3.354570 0.020817 -0.023480
C -0.789976 -0.650705 -0.324754
C 0.804699 -0.428315 -2.796944
C 0.703652 -1.906795 1.887990
C -1.240652 0.638916 0.072111
C -1.750448 -1.610588 -0.648096
C -2.616235 0.931168 0.134445
C -3.121006 -1.326720 -0.588227
C -3.545232 -0.056848 -0.197105
C -0.653036 2.885317 0.792915
C 0.688807 3.551621 1.032366
H 0.756120 -2.113437 -0.752794
H 3.228131 0.502518 -2.144378
H 3.192125 -1.249267 -1.793920
H 3.138975 -2.032278 0.692160
H 3.138333 -0.797578 1.983879
H 4.456977 0.010364 -0.002922
H 3.030685 1.038182 0.290038
H 0.991783 -1.447805 -3.163024
H 1.241714 0.286962 -3.511642
H -0.284850 -0.250721 -2.799421
H -0.387200 -1.748963 1.949722
H 1.103920 -1.737161 2.900104
H 0.888399 -2.953971 1.609286
H -1.431984 -2.607434 -0.955465
H -2.966809 1.911153 0.435763
H -3.845053 -2.093181 -0.845478
H -4.609631 0.170821 -0.148378
H -1.224972 3.356314 -0.023874
H -1.263040 2.810309 1.708540
H 0.574230 4.589634 1.356430
H 1.264392 3.005182 1.794240
H 1.301482 3.532346 0.118762


%chk=000288753-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288753

0 1
O -0.298699 1.615329 0.394845
N 1.449490 -0.149034 -1.418469
N 1.398501 -0.873371 0.937707
C 0.746611 -0.984627 -0.400248
C 2.894045 -0.466502 -1.501048
C 2.842689 -1.199124 0.885276
C 3.557174 -0.293524 -0.127560
C -0.744428 -0.645037 -0.327802
C 0.812431 -0.230220 -2.747915
C 0.711767 -1.680632 1.965764
C -1.240007 0.639726 0.065579
C -1.685125 -1.644476 -0.661710
C -2.640750 0.876120 0.109918
C -3.079963 -1.417579 -0.619535
C -3.552313 -0.147282 -0.230706
C -0.779867 2.944097 0.816734
C 0.467744 3.769209 1.123477
H 0.808330 -2.075982 -0.734693
H 3.352323 0.210330 -2.245796
H 3.064049 -1.520222 -1.859363
H 3.010932 -2.274690 0.598011
H 3.263042 -1.061494 1.898731
H 4.629458 -0.561165 -0.186880
H 3.466785 0.759082 0.193365
H 0.810613 -1.266323 -3.177485
H 1.361857 0.426074 -3.446326
H -0.231258 0.118854 -2.697618
H -0.333661 -1.352567 2.080456
H 1.225894 -1.536684 2.932933
H 0.706683 -2.778982 1.738472
H -1.305376 -2.628721 -0.962647
H -3.027302 1.854656 0.408569
H -3.779518 -2.216868 -0.884710
H -4.628741 0.055306 -0.189602
H -1.377239 3.403741 0.001505
H -1.426208 2.842458 1.713831
H 0.184337 4.787385 1.447783
H 1.055801 3.290855 1.924699
H 1.106701 3.845885 0.227656


