%chk=000267789.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267789

0 1
O 0.128432 0.404944 -1.601077
O -1.704107 2.231692 -1.268846
O 0.877897 -2.518318 0.704348
O -3.696537 1.963720 0.582703
N 2.069126 -3.058439 -2.208064
C -0.193717 -3.168626 -1.335267
C -0.911393 -1.113918 0.053909
C 0.032402 -2.254694 -0.123085
C -0.805257 0.107310 -0.640863
C -0.843193 -2.459549 -2.520451
C 1.124077 -3.810635 -1.765243
C -1.778123 1.116520 -0.456172
C -1.957320 -1.285121 0.972079
C -2.834462 0.904402 0.462709
C -2.916847 -0.297874 1.183658
C 1.539076 0.166006 -1.298919
C 1.174852 -5.305721 -1.614163
C 1.977113 0.992671 -0.124991
C 2.224557 0.384609 1.113745
C 2.131259 2.380184 -0.265425
C 2.637393 1.160376 2.200708
C 2.541709 3.151728 0.824592
C -1.451962 3.467537 -0.543096
C 2.798191 2.542167 2.057538
C -4.790121 1.840604 1.527832
H -0.896117 -3.968213 -0.974574
H -1.847051 -2.092383 -2.274470
H -0.249222 -1.584160 -2.837789
H -0.929159 -3.122882 -3.387568
H -2.023298 -2.218264 1.536357
H -3.713387 -0.466489 1.900382
H 1.990283 0.494744 -2.257644
H 1.722804 -0.917258 -1.178365
H 2.094472 -5.746744 -2.018470
H 0.334606 -5.797109 -2.121950
H 1.129205 -5.588708 -0.550975
H 2.085497 -0.695560 1.233881
H 1.922365 2.852775 -1.224864
H 2.949239 -3.476892 -2.495365
H 2.831194 0.685038 3.160690
H 2.664669 4.226922 0.713447
H -1.404210 4.197749 -1.357513
H -2.286228 3.677013 0.134661
H -0.500240 3.399560 -0.008939
H 3.121579 3.143360 2.904816
H -5.296016 2.807378 1.403842
H -5.448897 1.016051 1.240988
H -4.404131 1.724397 2.544263


%chk=000267789-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267789

0 1
O 0.064968 0.321352 -1.717126
O -1.740244 2.277424 -1.257368
O 0.414737 -2.949066 0.747810
O -3.702529 2.027925 0.695955
N 2.028141 -3.044565 -2.572980
C -0.208888 -3.170150 -1.597025
C -0.995661 -1.166124 -0.015667
C -0.171471 -2.404152 -0.238773
C -0.902899 0.063895 -0.737102
C -0.818953 -2.437125 -2.807701
C 1.182502 -3.772121 -1.890173
C -1.818386 1.121613 -0.472644
C -1.952012 -1.269145 1.027496
C -2.821654 0.951147 0.530608
C -2.869403 -0.238542 1.295710
C 1.513927 0.098905 -1.353904
C 1.442891 -5.155676 -1.322443
C 1.938954 0.924408 -0.160556
C 2.028889 0.338172 1.128442
C 2.238414 2.303379 -0.312997
C 2.414327 1.117676 2.243154
C 2.624258 3.083144 0.799150
C -1.457534 3.543941 -0.545710
C 2.714036 2.489993 2.081808
C -4.756935 1.892683 1.706123
H -0.876359 -4.025734 -1.347123
H -1.804591 -2.008879 -2.554318
H -0.164373 -1.627310 -3.157040
H -0.956708 -3.153324 -3.637505
H -1.982813 -2.193115 1.613919
H -3.615921 -0.373124 2.082957
H 2.020986 0.411977 -2.280126
H 1.701530 -0.979215 -1.214864
H 2.456107 -5.521474 -1.566055
H 0.700677 -5.881606 -1.707655
H 1.324699 -5.114370 -0.223218
H 1.794435 -0.724867 1.261022
H 2.164140 2.760088 -1.307640
H 2.942008 -3.526748 -2.713633
H 2.481930 0.654037 3.233714
H 2.862443 4.144961 0.668168
H -1.395259 4.303856 -1.339586
H -2.270776 3.790036 0.158466
H -0.490732 3.473030 -0.012299
H 3.018543 3.092311 2.945508
H -5.332881 2.827364 1.642708
H -5.415137 1.031847 1.481743
H -4.330425 1.783169 2.721773


