%chk=000281671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281671

0 1
O 2.171083 0.884133 1.164245
O 0.710897 2.088804 -2.053836
O 3.989586 -1.262191 0.632217
O -3.601952 -1.857029 2.251239
O -4.475080 -0.221542 1.000505
N -1.332019 2.898470 -1.570104
C -0.440846 0.991981 -0.184266
C -1.875579 0.392254 -0.137329
C 0.551709 -0.134070 -0.378666
C -2.170011 -0.319430 -1.469778
C -0.107051 1.788708 1.097435
C -1.116197 -1.363000 -1.866696
C 0.226601 -1.229796 -1.200480
C -2.040740 -0.571182 1.053356
C -0.286800 1.989369 -1.365906
C 1.801395 -0.099757 0.263398
C 1.383884 2.106818 1.126736
C 1.164947 -2.253718 -1.396841
C 2.745620 -1.135179 0.054537
C 2.416997 -2.208509 -0.785656
C -3.482134 -0.802420 1.373995
C 4.567273 -0.084901 1.250329
H -2.617594 1.221640 -0.003738
H -2.261029 0.432825 -2.278613
H -3.168128 -0.800265 -1.415804
H -0.375993 1.182774 1.990840
H -0.706355 2.715268 1.164976
H -0.967543 -1.323192 -2.968925
H -1.515451 -2.379990 -1.662047
H -1.527533 -1.542006 0.850645
H -1.516221 -0.181913 1.958991
H 1.716345 2.684005 0.241944
H 1.705365 2.603127 2.059172
H 0.922617 -3.097704 -2.040974
H 3.153331 -2.995541 -0.946951
H -1.273970 3.540424 -2.347910
H -2.230687 2.821125 -1.129019
H -4.545967 -2.044927 2.502249
H 3.993948 0.180253 2.146366
H 4.593073 0.746284 0.540103
H 5.574211 -0.435399 1.502262


%chk=000281671-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281671

0 1
O 2.213782 0.961682 1.238558
O 0.847198 2.081175 -1.872400
O 4.047448 -1.128670 0.838464
O -3.980142 -2.097397 1.703853
O -4.700617 -0.204631 0.573365
N -1.205447 2.993913 -1.359522
C -0.461466 0.973170 -0.057097
C -1.925383 0.420393 -0.138934
C 0.544225 -0.175165 -0.233567
C -2.095327 -0.289425 -1.507127
C -0.154008 1.709284 1.286283
C -1.164292 -1.516768 -1.628758
C 0.216200 -1.325889 -1.002313
C -2.286642 -0.514938 1.042123
C -0.217783 2.033363 -1.192494
C 1.822907 -0.090560 0.385209
C 1.318478 2.134040 1.328176
C 1.172668 -2.357639 -1.149966
C 2.786614 -1.124995 0.210879
C 2.446449 -2.254579 -0.559866
C -3.758233 -0.879346 1.047714
C 4.927170 0.032407 0.589085
H -2.645296 1.262147 -0.088961
H -1.863301 0.435605 -2.309373
H -3.148214 -0.592505 -1.650703
H -0.339548 1.031523 2.139180
H -0.801262 2.598286 1.407069
H -1.050093 -1.783476 -2.696980
H -1.644176 -2.396990 -1.153089
H -1.678336 -1.434066 1.049456
H -2.096259 -0.013987 2.011890
H 1.568602 2.825355 0.502065
H 1.578571 2.604259 2.290480
H 0.918793 -3.245586 -1.740913
H 3.200306 -3.039257 -0.676623
H -1.049543 3.714964 -2.064213
H -2.099036 2.966426 -0.872705
H -4.958435 -2.285163 1.727004
H 4.487234 0.956510 0.998590
H 5.110869 0.151137 -0.496473
H 5.869326 -0.210007 1.104633


