%chk=000299688.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299688

0 1
O -3.702354 -1.855096 0.226317
N -4.848363 0.088850 0.123724
C 0.535654 0.448994 -0.241202
C 3.063149 0.249937 0.180028
C 1.883476 1.189588 -0.141545
C 0.061007 -0.040822 1.141804
C -0.533102 1.368913 -0.869626
C -2.354199 0.154990 0.405781
C -1.289172 -0.757016 1.044596
C -1.884779 0.652665 -0.974718
C 3.391803 -0.665284 -1.017264
C 4.307934 1.073824 0.573160
C 4.578374 -1.585159 -0.700303
C 5.497510 0.157346 0.891432
C 5.815176 -0.775504 -0.285813
C -3.657487 -0.631063 0.249005
C -6.132603 -0.637086 0.001922
C -4.924562 1.562974 0.135330
H 0.664076 -0.442416 -0.904975
H 2.781486 -0.394686 1.049199
H 1.816934 1.978787 0.631064
H 2.085775 1.723421 -1.089503
H -0.009849 0.811616 1.842582
H 0.816007 -0.725983 1.574114
H -0.207123 1.693978 -1.875168
H -0.637779 2.291040 -0.268265
H -2.513431 1.030421 1.080480
H -1.195173 -1.689338 0.448976
H -1.625267 -1.084852 2.046307
H -2.641894 1.332889 -1.412150
H -1.802743 -0.206613 -1.670859
H 3.620662 -0.052467 -1.908902
H 2.504385 -1.270974 -1.281507
H 4.081316 1.709720 1.447970
H 4.577381 1.763891 -0.248091
H 4.814663 -2.210564 -1.580975
H 4.302476 -2.288041 0.108995
H 5.276335 -0.443217 1.794536
H 6.385702 0.767472 1.139058
H 6.640840 -1.458607 -0.014596
H 6.177207 -0.180841 -1.146125
H -6.624655 -0.408096 -0.956233
H -6.810511 -0.381054 0.830826
H -5.949764 -1.731900 0.035898
H -4.179010 2.001143 -0.555143
H -4.745819 1.962794 1.148614
H -5.918087 1.910927 -0.191657


%chk=000299688-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299688

0 1
O -3.812354 -1.827664 -0.307085
N -4.921223 0.147309 0.217109
C 0.536075 0.406924 -0.436562
C 3.100475 0.286484 0.188097
C 1.894266 1.138804 -0.282844
C 0.049402 -0.239165 0.885883
C -0.539329 1.390130 -0.967217
C -2.400628 0.100639 0.229243
C -1.338936 -0.903478 0.742482
C -1.927577 0.728782 -1.116687
C 3.447937 -0.859979 -0.798098
C 4.342502 1.190929 0.407026
C 4.687024 -1.666747 -0.339448
C 5.580320 0.389756 0.873175
C 5.913410 -0.749607 -0.119028
C -3.755416 -0.601337 0.035795
C -6.226904 -0.522823 0.080576
C -4.968502 1.563832 0.612632
H 0.646265 -0.403510 -1.189438
H 2.850410 -0.174021 1.169208
H 1.756385 1.977409 0.434606
H 2.157310 1.605904 -1.257105
H 0.012758 0.545443 1.672943
H 0.777610 -0.997955 1.231525
H -0.217132 1.805409 -1.943242
H -0.614713 2.249307 -0.265778
H -2.490161 0.912763 0.978845
H -1.292160 -1.752503 0.035621
H -1.662973 -1.324551 1.713575
H -2.664849 1.471863 -1.481640
H -1.882992 -0.076240 -1.876974
H 3.646831 -0.419264 -1.798901
H 2.583299 -1.541648 -0.916755
H 4.101615 1.983113 1.144490
H 4.581435 1.706948 -0.547957
H 4.923933 -2.452938 -1.082875
H 4.449331 -2.187567 0.611742
H 5.377927 -0.047418 1.873294
H 6.450823 1.064888 0.989189
H 6.774473 -1.341557 0.248351
H 6.217705 -0.307966 -1.091126
H -6.823262 -0.058976 -0.728752
H -6.800514 -0.455477 1.025588
H -6.043330 -1.580313 -0.162441
H -4.058815 2.100298 0.305836
H -5.100051 1.684729 1.707689
H -5.826101 2.050538 0.112529


