%chk=000269715.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269715

0 1
O 5.241340 -0.250559 0.132169
N -1.342588 0.035340 -0.112019
N 1.527574 -0.389888 0.102184
C -0.406441 1.182301 0.180630
C 0.968944 0.876130 -0.472552
C -0.766138 -1.238113 0.437539
C 0.600753 -1.525797 -0.210690
C -2.715969 0.256299 0.453484
C -0.949873 2.486173 -0.418957
C 2.906462 -0.655347 -0.414311
C -3.722272 -0.599798 -0.336838
C 3.896380 0.033197 0.542947
C -5.151448 -0.352773 0.136299
H -0.257461 1.314691 1.284278
H 0.853676 0.834180 -1.577548
H 1.670581 1.704849 -0.243728
H -1.466445 -2.066562 0.193613
H -0.654551 -1.214855 1.544482
H 1.024288 -2.456369 0.223688
H 0.472178 -1.693118 -1.302199
H -2.780517 0.027180 1.538179
H -2.991082 1.329642 0.346969
H -0.239760 3.309243 -0.295835
H -1.158712 2.373642 -1.491092
H -1.891805 2.787029 0.057177
H 3.069564 -0.314608 -1.457257
H 3.119102 -1.747395 -0.416184
H -3.628130 -0.370315 -1.417735
H -3.469608 -1.673601 -0.240364
H 3.848469 -0.396631 1.561937
H 3.747176 1.123928 0.597038
H -5.276929 -0.596240 1.197278
H -5.448843 0.693295 0.000742
H -5.863282 -0.968064 -0.426253
H 5.434267 0.160213 -0.730771


%chk=000269715-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269715

0 1
O 5.322272 -0.194859 0.089779
N -1.344267 0.055564 -0.158620
N 1.525401 -0.424983 0.076480
C -0.411046 1.168484 0.211995
C 0.987635 0.877185 -0.379161
C -0.793125 -1.247120 0.302912
C 0.592196 -1.511615 -0.300748
C -2.732726 0.268502 0.334504
C -0.899668 2.536881 -0.307009
C 2.917867 -0.668505 -0.358740
C -3.753146 -0.751933 -0.216550
C 3.941692 0.073670 0.525396
C -5.203707 -0.339825 0.117912
H -0.295948 1.218206 1.326643
H 0.906828 0.914649 -1.497490
H 1.673595 1.682533 -0.059854
H -1.474698 -2.055159 -0.013379
H -0.711174 -1.279485 1.419888
H 0.984919 -2.469658 0.088155
H 0.488200 -1.601897 -1.411960
H -2.774767 0.260468 1.457060
H -3.059251 1.271623 0.008579
H -0.088463 3.282972 -0.219515
H -1.190044 2.460255 -1.370780
H -1.759639 2.924521 0.264817
H 3.078389 -0.381499 -1.433382
H 3.129844 -1.750947 -0.283230
H -3.618292 -0.821054 -1.313234
H -3.563684 -1.761127 0.196789
H 3.889084 -0.304312 1.557707
H 3.740193 1.165337 0.541182
H -5.351439 -0.248574 1.210947
H -5.455822 0.636032 -0.338272
H -5.927528 -1.085340 -0.258114
H 5.429220 0.118308 -0.844407


