%chk=000206282.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206282

0 1
O -2.886058 -0.291137 -2.173145
N -0.394963 1.615509 -0.596614
N 2.293879 0.895467 0.221749
C 0.567010 2.650042 -0.096106
C 0.356766 0.513619 -1.283578
C 1.537530 1.995051 0.908561
C 1.333094 -0.138809 -0.286930
C -1.439182 2.208959 -1.493146
C -2.822437 1.778962 -0.949148
C 3.290259 0.285973 1.165910
C -3.952914 2.459912 -1.719841
C -2.972555 0.261230 -1.097538
C 4.195023 -0.678885 0.435798
C -3.250161 -0.507081 0.158157
C 4.458788 -1.942132 0.984711
C 4.799885 -0.306833 -0.774797
C -2.432170 -0.342364 1.283624
C -4.317991 -1.414060 0.187596
C 5.324941 -2.822260 0.328714
C 5.661100 -1.191242 -1.427422
C 5.927328 -2.449662 -0.876375
C -2.693325 -1.077292 2.443154
C -4.581449 -2.138902 1.353301
C -3.769952 -1.970144 2.480212
H -0.010031 3.446787 0.419006
H 1.148034 3.130069 -0.914049
H 0.916491 0.867470 -2.176952
H -0.377336 -0.246447 -1.635069
H 2.267421 2.756189 1.257632
H 0.971971 1.642452 1.798228
H 0.764620 -0.639161 0.526497
H 1.918971 -0.926617 -0.810998
H -1.338222 1.879240 -2.551165
H -1.387282 3.317019 -1.513385
H -2.885977 2.066286 0.129603
H 2.811253 -0.206925 2.040881
H 3.920132 1.111127 1.576491
H -3.951754 2.166424 -2.779211
H -4.934330 2.193695 -1.309150
H -3.867379 3.551298 -1.677430
H 3.992356 -2.243436 1.919810
H 4.579821 0.671644 -1.204493
H -1.585375 0.351519 1.244240
H -4.933791 -1.556253 -0.701244
H 5.528424 -3.801349 0.758466
H 6.126293 -0.900314 -2.367606
H 6.599992 -3.136170 -1.385383
H -2.058213 -0.954390 3.318102
H -5.414011 -2.839433 1.380681
H -3.974524 -2.537842 3.386751


%chk=000206282-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206282

0 1
O -3.528683 0.056037 -2.261502
N -0.420382 1.794428 -0.553504
N 2.215517 0.886926 0.245912
C 0.668856 2.758194 -0.257744
C 0.140554 0.517821 -1.066754
C 1.649725 2.155471 0.761425
C 1.133045 -0.081570 -0.060097
C -1.513060 2.346403 -1.385467
C -2.950487 1.972118 -0.886201
C 3.253555 0.325272 1.140203
C -3.999248 2.810814 -1.659472
C -3.248230 0.478581 -1.096281
C 4.104077 -0.754349 0.475859
C -3.231648 -0.470745 0.068780
C 4.565878 -1.865855 1.222263
C 4.487849 -0.635408 -0.884025
C -2.578084 -0.162231 1.293174
C -3.873142 -1.732169 -0.079099
C 5.405312 -2.836583 0.628051
C 5.321791 -1.605587 -1.481925
C 5.786909 -2.708869 -0.727128
C -2.574124 -1.099359 2.349559
C -3.880730 -2.658097 0.981888
C -3.232459 -2.342429 2.201792
H 0.225258 3.679549 0.163552
H 1.239413 3.035803 -1.178979
H 0.661300 0.674394 -2.043709
H -0.680560 -0.199829 -1.236256
H 2.476713 2.868499 0.940722
H 1.106628 2.002540 1.729895
H 0.576800 -0.372224 0.867162
H 1.583943 -0.995494 -0.485714
H -1.424074 2.036120 -2.452380
H -1.448317 3.451148 -1.362736
H -2.999113 2.221868 0.187722
H 2.815015 -0.084356 2.086818
H 3.911666 1.167071 1.438871
H -3.985676 2.546833 -2.730907
H -5.018932 2.620738 -1.279721
H -3.788312 3.890616 -1.551148
H 4.265924 -1.974154 2.272545
H 4.110792 0.218403 -1.458043
H -2.032827 0.782563 1.394683
H -4.354446 -1.958199 -1.036582
H 5.754634 -3.691671 1.218149
H 5.609855 -1.503233 -2.534682
H 6.434319 -3.461742 -1.190981
H -2.058480 -0.861730 3.286691
H -4.386573 -3.622854 0.864481
H -3.237742 -3.062672 3.027940


