%chk=000212312.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212312

1 1
O 4.877776 1.446793 -1.437990
O -1.399663 -1.900075 -0.245677
N 3.449554 -0.590061 0.319432
C 2.141747 0.190083 0.509161
C 4.646068 0.293294 0.692403
C 0.895538 -0.671366 0.289034
C 3.576497 -1.052362 -1.114482
C 3.472163 -1.801235 1.230748
C 4.700539 1.646848 -0.040951
C -0.373649 0.183246 0.236178
C -1.579397 -0.714196 -0.053297
C -2.923503 -0.090662 -0.085960
C -3.136676 1.288660 0.077041
C -4.024919 -0.940867 -0.295195
C -4.431555 1.805750 0.032878
C -5.320021 -0.419471 -0.337832
C -5.524419 0.953226 -0.173862
H 2.126005 0.627192 1.533915
H 2.138196 1.047891 -0.209251
H 4.636517 0.475714 1.793994
H 5.585305 -0.273619 0.479929
H 0.778150 -1.431386 1.092689
H 0.966279 -1.259167 -0.656082
H 3.707111 -0.185724 -1.807385
H 4.449497 -1.710841 -1.262861
H 2.675706 -1.605573 -1.445979
H 3.277913 -1.528995 2.284331
H 2.700081 -2.544026 0.942710
H 4.443271 -2.328876 1.192403
H 3.748672 2.214519 0.028186
H 5.513629 2.271236 0.382021
H -0.306387 0.961338 -0.551178
H -0.535837 0.721705 1.191522
H 5.830543 1.477375 -1.691639
H -2.301443 1.967900 0.236824
H -3.855675 -2.015353 -0.425019
H -4.596890 2.876163 0.158738
H -6.169933 -1.084413 -0.499898
H -6.535988 1.363436 -0.207202


%chk=000212312-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212312

1 1
O 4.603590 1.617817 -1.301708
O -1.485288 -2.012406 -0.022926
N 3.515024 -0.677125 0.276988
C 2.173235 0.105820 0.318414
C 4.687245 0.247318 0.705775
C 0.917895 -0.761385 0.155412
C 3.776789 -1.219061 -1.134136
C 3.482822 -1.850941 1.255489
C 4.663624 1.677673 0.158900
C -0.345570 0.126656 0.121581
C -1.612914 -0.751620 0.010148
C -2.947965 -0.091764 -0.052616
C -3.104101 1.322504 -0.021806
C -4.104420 -0.917066 -0.146199
C -4.389798 1.897475 -0.083876
C -5.386974 -0.340760 -0.207802
C -5.532660 1.067905 -0.176991
H 2.158682 0.626815 1.293777
H 2.247230 0.855497 -0.487748
H 4.666199 0.294175 1.808772
H 5.609413 -0.266601 0.386671
H 0.805369 -1.483168 0.982393
H 0.943145 -1.354942 -0.775529
H 3.925586 -0.364153 -1.807323
H 4.686973 -1.838594 -1.104735
H 2.921577 -1.836195 -1.443066
H 3.149216 -1.495545 2.242797
H 2.792177 -2.619864 0.882905
H 4.497104 -2.273090 1.331580
H 3.812098 2.256257 0.568705
H 5.598783 2.155712 0.515456
H -0.314900 0.829288 -0.734762
H -0.420457 0.748482 1.036518
H 4.840223 2.489391 -1.704464
H -2.231673 1.981324 0.049532
H -3.967950 -2.003156 -0.168331
H -4.505708 2.985943 -0.060463
H -6.272135 -0.980888 -0.279506
H -6.530686 1.516376 -0.225428


