%chk=000268029.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268029

0 1
O 4.602302 -1.727020 0.002013
N 4.277757 0.499985 -0.216287
C 0.090054 0.091100 0.657868
C -0.732715 0.103662 -0.641939
C 1.559043 0.195000 0.356979
C -2.203613 0.013161 -0.337144
C 2.361441 -0.910847 0.340023
C 2.117251 1.491326 0.079915
C -2.823217 -1.240225 -0.216831
C -2.962708 1.180545 -0.164382
C 3.776596 -0.833830 0.051690
C 3.452568 1.616015 -0.197198
C -4.188265 -1.322300 0.069972
C -4.327693 1.092675 0.122179
C -4.943393 -0.157367 0.239776
H -0.231793 0.924277 1.317729
H -0.134244 -0.833049 1.231925
H -0.508741 1.020918 -1.224424
H -0.416621 -0.737612 -1.294078
H 1.983332 -1.912650 0.541230
H 1.468791 2.362184 0.094477
H -2.241309 -2.150530 -0.347337
H -2.490410 2.156270 -0.253814
H 3.916676 2.585266 -0.411544
H -4.665001 -2.297122 0.161015
H -4.913149 2.001206 0.253825
H 5.273484 0.599102 -0.422621
H -6.006123 -0.223637 0.462082


%chk=000268029-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268029

0 1
O 4.697125 -1.786138 0.155610
N 4.308521 0.492401 -0.213579
C 0.106876 0.088401 0.650805
C -0.747963 0.141813 -0.659247
C 1.594266 0.209016 0.370915
C -2.236879 0.032867 -0.367707
C 2.436004 -0.898574 0.427718
C 2.142527 1.496540 0.007001
C -2.870199 -1.235011 -0.298354
C -3.015805 1.191879 -0.116305
C 3.862293 -0.827513 0.132324
C 3.493032 1.604858 -0.273498
C -4.243893 -1.343716 0.014889
C -4.389957 1.089045 0.197571
C -5.008857 -0.180798 0.265345
H -0.224430 0.910420 1.314955
H -0.109596 -0.859352 1.176336
H -0.528714 1.088109 -1.189810
H -0.420120 -0.681869 -1.320902
H 2.057369 -1.887443 0.703758
H 1.508346 2.385833 -0.034500
H -2.284088 -2.141049 -0.498370
H -2.543611 2.181124 -0.174218
H 3.968265 2.551759 -0.544845
H -4.717753 -2.330971 0.059214
H -4.977547 1.995212 0.384414
H 5.309837 0.562451 -0.420224
H -6.074751 -0.262789 0.505802


