%chk=000299128.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299128

0 1
O -5.028223 2.099244 -0.026591
O -2.894379 2.349049 -0.225521
O -5.898057 -3.984756 0.287873
O -7.096264 -2.182816 0.320286
N -0.086787 -0.350727 -0.336591
N -1.295904 0.314580 -0.257022
N -3.901635 1.646496 -0.104769
N -6.029683 -2.771835 0.252701
C 2.279491 -0.493094 -0.526267
C 2.862380 -1.038662 0.667669
C 4.076331 -1.766061 0.546185
C 1.027892 0.317458 -0.448988
C 2.869211 -0.677414 -1.754360
C 4.087594 -1.419114 -1.868648
C 4.673621 -1.945463 -0.739730
C 1.204227 1.793006 -0.523158
C 2.275056 -0.880446 1.962800
C 4.683322 -2.312327 1.723251
C 1.928164 2.452134 0.477972
C 4.688939 -1.597101 -3.223589
C 2.877738 -1.415765 3.073470
C 4.099629 -2.139756 2.952507
C 0.650482 2.509018 -1.593085
C 2.089601 3.844654 0.420993
C 0.815277 3.896587 -1.647081
C 1.525536 4.563431 -0.647405
C -2.445480 -0.440303 -0.135710
C 2.845869 4.564856 1.487573
C -3.726234 0.203584 -0.056499
C -2.403096 -1.874722 -0.086110
C -4.896265 -0.578251 0.072166
C -4.813205 -1.961436 0.118979
C -3.547389 -2.615126 0.037546
H 2.421714 -0.262452 -2.657244
H 5.602361 -2.510278 -0.805194
H 1.334252 -0.338241 2.053606
H 5.614824 -2.867076 1.619082
H 2.370321 1.881829 1.295328
H 4.001382 -2.128030 -3.898677
H 4.919184 -0.627792 -3.689840
H 5.624044 -2.172555 -3.202421
H 2.432783 -1.300734 4.060740
H 4.555062 -2.552912 3.851768
H 0.104395 1.994923 -2.381846
H 0.381726 4.460382 -2.473807
H 1.642700 5.645324 -0.694896
H -1.351830 1.366602 -0.275541
H 3.388219 3.886194 2.159639
H 3.589770 5.255119 1.064087
H 2.168281 5.164717 2.114370
H -1.424915 -2.368842 -0.148742
H -5.878794 -0.074355 0.134501
H -3.519835 -3.712743 0.076940


%chk=000299128-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299128

0 1
O -4.913711 2.372505 0.096515
O -2.666753 2.493959 -0.264727
O -5.946874 -3.716687 1.192084
O -7.136567 -1.770506 1.035428
N 0.005770 -0.368506 -0.080046
N -1.185719 0.345684 -0.085339
N -3.756045 1.812495 0.013720
N -6.030037 -2.438873 0.996145
C 2.413451 -0.464019 -0.298207
C 2.664666 -1.585111 0.599498
C 3.954076 -2.248142 0.511327
C 1.130860 0.287134 -0.368645
C 3.432833 -0.052477 -1.180518
C 4.699347 -0.707395 -1.271015
C 4.936331 -1.798391 -0.430468
C 1.161246 1.733583 -0.778522
C 1.742282 -2.050305 1.595183
C 4.247304 -3.350102 1.381534
C 1.927072 2.664059 -0.026160
C 5.734621 -0.221151 -2.267913
C 2.062342 -3.118123 2.439886
C 3.319798 -3.785484 2.328317
C 0.429168 2.190209 -1.906086
C 1.959343 4.038290 -0.363510
C 0.466211 3.555780 -2.261744
C 1.219814 4.471180 -1.496541
C -2.365984 -0.315724 0.171940
C 2.750924 5.030213 0.469905
C -3.637353 0.371912 0.229888
C -2.372042 -1.735282 0.389956
C -4.833382 -0.327653 0.500997
C -4.783395 -1.709799 0.712719
C -3.551447 -2.422869 0.656010
H 3.239990 0.795640 -1.846934
H 5.896296 -2.328034 -0.478252
H 0.771468 -1.560779 1.682532
H 5.223442 -3.841792 1.292737
H 2.501462 2.306099 0.836523
H 5.360761 -0.303297 -3.306012
H 5.986222 0.842660 -2.098724
H 6.668026 -0.805043 -2.199001
H 1.340467 -3.446530 3.195881
H 3.553680 -4.626569 2.989782
H -0.143905 1.481330 -2.514512
H -0.095868 3.904160 -3.134580
H 1.235270 5.531374 -1.776863
H -1.251382 1.371551 -0.249345
H 3.453206 4.520636 1.151386
H 3.332524 5.719777 -0.168255
H 2.076764 5.651532 1.089898
H -1.414114 -2.255150 0.331257
H -5.782070 0.213380 0.542586
H -3.556985 -3.503349 0.820985


