%chk=000299417.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299417

0 1
O -5.336389 0.098518 1.035144
O -1.622763 -1.369601 -0.446181
O 2.719258 -2.092318 0.727124
O 4.555550 0.106202 0.752208
N -3.192706 0.288984 -0.877432
N -0.903672 0.838071 -0.367930
C -3.749209 1.490836 -0.192245
C -4.216010 -0.800237 -0.951879
C -4.341761 1.129280 1.181448
C -4.821126 -1.106141 0.425912
C -1.875569 -0.179367 -0.515799
C 0.487172 0.616796 -0.111468
C 1.005858 -0.654274 0.176723
C 1.328428 1.746096 -0.130733
C 2.371590 -0.796442 0.449884
C 3.223489 0.343820 0.432768
C 2.690983 1.599815 0.145709
C 4.113756 -2.389308 0.996444
C 5.508229 1.124944 0.365057
H -4.552333 1.895860 -0.854121
H -2.986397 2.288824 -0.098909
H -3.750791 -1.716536 -1.385944
H -5.001464 -0.457851 -1.661803
H -3.568872 0.792141 1.894253
H -4.925076 1.958645 1.620250
H -5.725223 -1.737082 0.360026
H -4.084818 -1.569823 1.106951
H -1.166623 1.801414 -0.589877
H 0.366823 -1.547804 0.182795
H 0.937680 2.733351 -0.356346
H 3.329117 2.481326 0.136687
H 4.454620 -1.829026 1.874464
H 4.723273 -2.152963 0.118972
H 4.077749 -3.467237 1.190528
H 5.364119 2.024043 0.970885
H 5.434272 1.338402 -0.704740
H 6.462937 0.640842 0.605775


%chk=000299417-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299417

0 1
O -5.881652 0.525164 0.378020
O -1.500105 -1.659567 -0.123108
O 3.108269 -2.072179 0.993238
O 4.771426 0.224968 0.769915
N -3.120845 0.015004 -0.273861
N -0.821933 0.594880 -0.172968
C -3.616169 1.402582 -0.190689
C -4.165242 -0.988613 -0.577232
C -4.831542 1.472188 0.766238
C -5.342098 -0.851208 0.400139
C -1.786807 -0.422604 -0.182396
C 0.581094 0.459863 0.041843
C 1.208253 -0.769731 0.366314
C 1.374301 1.629116 -0.073501
C 2.598381 -0.825820 0.589481
C 3.395913 0.356388 0.489374
C 2.766537 1.574118 0.145195
C 4.259205 -2.618396 0.245632
C 5.577647 1.445687 0.743294
H -3.920767 1.765846 -1.195242
H -2.841046 2.080115 0.209229
H -3.699894 -1.985388 -0.503164
H -4.530923 -0.836636 -1.614201
H -4.493937 1.258957 1.804125
H -5.299762 2.469884 0.726382
H -6.182568 -1.499546 0.104403
H -5.015314 -1.106956 1.430532
H -1.123574 1.539152 -0.413448
H 0.624219 -1.688034 0.438499
H 0.909502 2.589503 -0.330313
H 3.350920 2.494975 0.059636
H 5.144585 -1.970029 0.349407
H 3.999677 -2.739775 -0.824160
H 4.444979 -3.604915 0.697250
H 5.210436 2.185071 1.481720
H 5.588612 1.903282 -0.265709
H 6.594326 1.124852 1.014728


