%chk=000223235.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223235

0 1
O 2.335981 -3.193788 2.038925
N 0.509819 -2.430727 -1.513468
C 0.089376 3.548473 0.547048
C -0.786164 2.338601 0.901966
C 0.602017 3.532843 -0.900432
C -2.165408 2.390469 0.232083
C 1.594325 2.398098 -1.186656
C -3.023432 1.178472 0.619457
C 2.959931 2.626132 -0.526635
C -4.393259 1.216060 -0.071354
C 3.929919 1.458687 -0.776122
C -5.251315 0.004591 0.316858
C 3.529483 0.223559 -0.016168
C -6.620804 0.039771 -0.376120
C 2.775784 -0.780550 -0.649730
C 2.369772 -1.924249 0.040205
C 3.891399 0.073848 1.328775
C -7.479507 -1.163599 0.007021
C 1.571913 -3.015243 -0.624960
C 2.752765 -2.043986 1.394483
C 3.508273 -1.063987 2.045555
C -0.101164 -3.508192 -2.349600
C -0.543181 -1.745862 -0.705488
H -0.475756 4.484006 0.723283
H 0.952440 3.583282 1.241595
H -0.260706 1.405582 0.612065
H -0.906399 2.286306 2.001226
H -0.257962 3.441771 -1.593661
H 1.070429 4.508882 -1.131571
H -2.043957 2.431302 -0.868060
H -2.685433 3.326278 0.512150
H 1.167016 1.434285 -0.837451
H 1.720914 2.287288 -2.280531
H -2.494032 0.242845 0.354618
H -3.156676 1.147758 1.717984
H 3.409848 3.562334 -0.908366
H 2.827294 2.773634 0.563547
H -4.259558 1.246531 -1.169867
H -4.921920 2.152050 0.193258
H 4.955920 1.765623 -0.487990
H 3.987654 1.243895 -1.862678
H -4.723032 -0.932125 0.055312
H -5.387783 -0.025007 1.414944
H -7.151233 0.975914 -0.113283
H -6.485734 0.067630 -1.475074
H 2.483119 -0.669020 -1.697852
H 4.473938 0.847481 1.826313
H -6.999734 -2.107763 -0.274471
H -7.664511 -1.199764 1.086602
H -8.454372 -1.129304 -0.491887
H 2.262605 -3.617412 -1.260971
H 1.163050 -3.712777 0.143534
H 3.792271 -1.178430 3.086131
H 0.676959 -3.948397 -2.993178
H -0.853227 -3.057304 -3.016901
H -0.584947 -4.317901 -1.784420
H -0.072569 -0.944053 -0.111402
H -1.097126 -2.399868 -0.016978
H -1.261843 -1.266530 -1.388681
H 2.629233 -3.208343 2.980367


%chk=000223235-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223235

0 1
O 0.475650 -2.999062 2.076227
N 0.119982 -2.276200 -2.063156
C 0.318202 4.232154 0.182406
C -0.473424 3.111569 0.901745
C 0.885545 3.847588 -1.211956
C -1.705919 2.585974 0.129597
C 1.704463 2.532795 -1.248497
C -2.427583 1.440751 0.874786
C 2.949841 2.524494 -0.334456
C -3.632360 0.858270 0.101146
C 3.695237 1.154837 -0.328908
C -4.291231 -0.343235 0.814431
C 2.880981 0.038142 0.312910
C -5.480020 -0.946445 0.031114
C 2.128274 -0.873996 -0.469020
C 1.316073 -1.879679 0.104657
C 2.815648 -0.086020 1.724182
C -6.129622 -2.148111 0.750597
C 0.531402 -2.859197 -0.761884
C 1.277520 -1.974786 1.519139
C 2.023133 -1.085233 2.327651
C -0.223287 -3.310733 -3.057920
C -0.951236 -1.270706 -1.915350
H -0.335339 5.120718 0.060972
H 1.150837 4.553058 0.840824
H 0.203900 2.259131 1.115725
H -0.806472 3.490531 1.890526
H 0.049412 3.758539 -1.934310
H 1.517664 4.683953 -1.576283
H -1.394267 2.219280 -0.869822
H -2.415762 3.420183 -0.052484
H 1.050572 1.682629 -0.973511
H 2.029091 2.341418 -2.292688
H -1.697093 0.628318 1.075721
H -2.767012 1.803217 1.867988
H 3.652431 3.317753 -0.663226
H 2.658420 2.769947 0.705954
H -3.296711 0.540866 -0.908732
H -4.390091 1.653663 -0.060165
H 4.653334 1.277744 0.213904
H 3.949744 0.883644 -1.372203
H -3.526216 -1.130815 0.981366
H -4.638359 -0.029444 1.821405
H -6.242558 -0.158714 -0.138814
H -5.129607 -1.260434 -0.973858
H 2.141136 -0.813537 -1.563897
H 3.391689 0.599504 2.357921
H -5.394743 -2.960795 0.904757
H -6.515049 -1.852781 1.744900
H -6.974719 -2.561368 0.169504
H 1.172715 -3.737507 -0.978440
H -0.337718 -3.247208 -0.178696
H 1.988704 -1.175133 3.422048
H 0.635786 -3.990159 -3.202891
H -0.447473 -2.830960 -4.027860
H -1.110578 -3.931527 -2.771059
H -0.626537 -0.479332 -1.218042
H -1.907341 -1.704313 -1.522374
H -1.160856 -0.803349 -2.894320
H 0.492501 -2.949789 3.064019


