%chk=000262653.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262653

0 1
O -1.197310 0.933992 -2.188889
N 0.489608 3.005800 0.821679
C 0.540463 0.910812 -0.515783
C -1.639154 2.257246 -0.241939
C 1.319634 2.181296 -0.116077
C -0.770723 3.470377 0.153443
C -0.807382 1.308916 -1.107968
C 1.345359 0.046672 -1.500148
C -2.183066 1.531684 1.002650
C 1.274980 4.173082 1.321029
C 2.524959 -0.607063 -0.838099
C -2.923116 0.265705 0.671039
C 3.817412 -0.093499 -1.014370
C -4.123360 0.310662 -0.056667
C 2.342862 -1.744297 -0.033994
C -2.429645 -0.973928 1.100965
C 4.912010 -0.704236 -0.397027
C -4.814154 -0.863948 -0.351915
C 3.434128 -2.354110 0.583523
C -3.121706 -2.151805 0.808011
C 4.729566 -1.838350 0.407218
C -4.318270 -2.106637 0.078282
C 5.891921 -2.501034 1.073288
C -5.061949 -3.360403 -0.251444
H 0.332350 0.313694 0.412107
H -2.502390 2.618603 -0.855913
H 2.248297 1.877482 0.418771
H 1.639188 2.735623 -1.023857
H -0.583634 4.098818 -0.744229
H -1.329655 4.104576 0.875854
H 0.671473 -0.724550 -1.939493
H 1.659624 0.654435 -2.372942
H -1.343175 1.332212 1.705567
H -2.855004 2.219507 1.557823
H 1.608321 4.877374 0.544879
H 0.668272 4.726480 2.056200
H 2.164045 3.802058 1.857747
H 3.974301 0.783772 -1.638910
H -4.514719 1.266771 -0.399542
H 1.343677 -2.154160 0.105627
H -1.502789 -1.025228 1.669618
H 5.909451 -0.296037 -0.545227
H -5.739285 -0.818117 -0.922812
H 3.281958 -3.235125 1.203674
H -2.726036 -3.106514 1.147364
H 6.846418 -2.006802 0.852415
H 5.990065 -3.548018 0.752604
H 5.775566 -2.504249 2.166328
H -4.650711 -4.243276 0.253918
H -5.028529 -3.562352 -1.332305
H -6.120443 -3.289109 0.034227


%chk=000262653-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000262653

0 1
O -1.178315 1.112425 -2.352314
N 0.477091 3.053151 0.810446
C 0.535369 0.981565 -0.599719
C -1.646705 2.340664 -0.290259
C 1.304104 2.246668 -0.112369
C -0.758993 3.538062 0.157457
C -0.807140 1.426244 -1.189415
C 1.364895 0.123810 -1.588333
C -2.218051 1.598839 0.963315
C 1.238226 4.126660 1.476795
C 2.537130 -0.575634 -0.917011
C -2.937315 0.290524 0.666300
C 3.870825 -0.134654 -1.098318
C -4.085314 0.251282 -0.168030
C 2.320185 -1.694726 -0.068827
C -2.488234 -0.928847 1.229998
C 4.950181 -0.784564 -0.454683
C -4.755996 -0.961137 -0.425163
C 3.395446 -2.342591 0.572699
C -3.161097 -2.145864 0.971714
C 4.733254 -1.899096 0.392256
C -4.305349 -2.184933 0.138079
C 5.888384 -2.610247 1.077506
C -5.026000 -3.489660 -0.156705
H 0.311228 0.382934 0.307244
H -2.481040 2.721112 -0.908890
H 2.221274 1.927104 0.414174
H 1.622166 2.837992 -1.012500
H -0.535019 4.180835 -0.733169
H -1.319624 4.159911 0.881530
H 0.681295 -0.613636 -2.048550
H 1.719156 0.768546 -2.414724
H -1.385490 1.431338 1.669847
H -2.915206 2.307355 1.456121
H 1.626829 4.902430 0.770104
H 0.595754 4.633363 2.218994
H 2.101199 3.691521 2.011397
H 4.068729 0.721062 -1.756322
H -4.457075 1.177876 -0.622773
H 1.297533 -2.067263 0.076636
H -1.609949 -0.925599 1.888633
H 5.973481 -0.423586 -0.616485
H -5.641019 -0.962752 -1.073954
H 3.199754 -3.209254 1.217205
H -2.794097 -3.074804 1.425565
H 6.849399 -2.106483 0.875414
H 5.978999 -3.657017 0.729916
H 5.748788 -2.644077 2.174384
H -4.640248 -4.314405 0.467241
H -4.901159 -3.785044 -1.216109
H -6.112540 -3.402596 0.029950


