%chk=000208419.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208419

0 1
O -3.002149 -1.470023 0.345613
O 1.502112 -2.352819 0.491392
N -2.510452 1.388583 -0.279350
N 0.843241 -0.186404 0.017680
N -0.774555 -1.920481 0.439453
C -1.499695 0.368182 -0.082610
C -0.187905 0.766041 -0.166224
C -3.135505 1.328038 -1.639424
C -3.512752 1.452549 0.835327
C -1.879873 -1.014889 0.234708
C 0.589217 -1.567952 0.335030
C 2.244015 0.213054 -0.110052
C 0.241638 2.161708 -0.458033
C -4.262807 0.317336 -1.837856
C -2.833230 1.918452 2.122655
C -1.064072 -3.338071 0.792260
C 2.961802 0.571885 1.039863
C 2.837752 0.224935 -1.380508
C 4.298464 0.956570 0.904830
C 4.175146 0.613831 -1.493476
C 4.903075 0.981396 -0.356573
H -3.513798 2.356898 -1.840827
H -2.326762 1.138888 -2.379201
H -4.294891 2.183862 0.535514
H -4.026075 0.476698 1.003142
H 0.974432 2.538221 0.271370
H -0.621912 2.856598 -0.429972
H 0.691414 2.251086 -1.458109
H -3.993798 -0.677739 -1.450033
H -5.179662 0.613042 -1.317132
H -4.509075 0.200812 -2.897679
H -2.113656 1.177671 2.490171
H -2.285299 2.855747 1.968940
H -3.572263 2.084698 2.913553
H -2.105720 -3.586151 0.512910
H -0.945537 -3.495579 1.877268
H -0.375138 -4.018272 0.261750
H 2.490928 0.534938 2.021335
H 2.271579 -0.077747 -2.260027
H 4.872310 1.232290 1.789626
H 4.653289 0.623424 -2.472922
H 5.946168 1.280093 -0.452882


%chk=000208419-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208419

0 1
O -3.045712 -1.488755 0.549257
O 1.552713 -2.304336 0.849302
N -2.585486 1.304963 -0.185420
N 0.832392 -0.177185 0.138620
N -0.741864 -1.853881 0.781676
C -1.543004 0.363161 0.071519
C -0.210225 0.753397 -0.057578
C -2.932447 1.540718 -1.611936
C -3.720903 1.394593 0.774881
C -1.867663 -1.020632 0.462108
C 0.608522 -1.500599 0.612747
C 2.216611 0.183071 -0.143984
C 0.164532 2.177589 -0.378381
C -3.775736 0.426872 -2.281066
C -3.246238 1.682795 2.210096
C -0.993356 -3.237871 1.244741
C 3.135290 0.335740 0.917451
C 2.626489 0.366024 -1.483328
C 4.472010 0.690740 0.634108
C 3.963679 0.727065 -1.760593
C 4.887695 0.892637 -0.703059
H -3.478261 2.503829 -1.668785
H -1.989800 1.674329 -2.176748
H -4.353175 2.234387 0.424570
H -4.339881 0.474972 0.768800
H 1.037891 2.503743 0.211863
H -0.711393 2.807520 -0.152559
H 0.422650 2.319943 -1.444441
H -3.246981 -0.541837 -2.252305
H -4.742780 0.292315 -1.765924
H -3.979846 0.684349 -3.338058
H -2.629439 0.854574 2.602545
H -2.648821 2.611630 2.251898
H -4.117895 1.794082 2.880799
H -2.083457 -3.376947 1.275608
H -0.551479 -3.386178 2.243835
H -0.529205 -3.959283 0.552397
H 2.807611 0.161115 1.946722
H 1.909193 0.211966 -2.296723
H 5.188085 0.805306 1.454843
H 4.283989 0.867740 -2.798552
H 5.925696 1.167737 -0.919449


