%chk=000276046.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276046

0 1
O 0.899762 -1.021553 -1.513635
N 1.615044 0.186738 0.276990
C -0.810999 -0.050266 -0.101401
C -3.077595 -0.081919 -0.172044
C -1.912083 -0.666389 -1.016439
C -1.186171 1.461928 -0.131241
C -1.201406 -0.626120 1.292994
C -2.738558 1.436408 -0.177902
C -2.753743 -0.644869 1.241641
C 0.612877 -0.353798 -0.532006
C 3.060074 -0.026654 -0.020617
C 3.718422 -0.770857 1.147136
C 3.735481 1.326374 -0.273652
H -4.087928 -0.315036 -0.524640
H -1.882921 -1.762272 -1.057814
H -1.872211 -0.305278 -2.051606
H -0.764907 1.956932 -1.020077
H -0.810361 2.001378 0.748216
H -0.825177 -0.007891 2.118787
H -0.791070 -1.638397 1.432342
H -3.120357 1.922836 -1.087993
H -3.185002 1.962098 0.677392
H -3.199622 -0.036042 2.040212
H -3.146504 -1.665874 1.359682
H 1.392472 0.741856 1.093093
H 3.126795 -0.658442 -0.952393
H 4.771106 -0.983839 0.929125
H 3.687623 -0.198555 2.079497
H 3.223435 -1.732256 1.332757
H 3.252600 1.860781 -1.101301
H 4.788776 1.191160 -0.544411
H 3.705447 1.980319 0.603406


%chk=000276046-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276046

0 1
O 0.918017 -1.594643 -0.870125
N 1.654190 0.218231 0.377909
C -0.790114 -0.136807 0.103334
C -3.002668 0.241863 -0.362893
C -1.709760 -0.081339 -1.159780
C -1.057972 1.264886 0.740137
C -1.546515 -1.206720 0.969995
C -2.579621 1.521146 0.421211
C -3.060823 -0.950381 0.636146
C 0.652221 -0.557837 -0.179493
C 3.090566 -0.094499 0.194873
C 3.886780 0.398241 1.419401
C 3.622478 0.499293 -1.131225
H -3.919794 0.371986 -0.961073
H -1.734957 -1.046830 -1.691750
H -1.416643 0.716466 -1.866881
H -0.432557 2.047701 0.267568
H -0.854902 1.272238 1.827832
H -1.318962 -1.086927 2.045230
H -1.227725 -2.218006 0.663755
H -2.702897 2.423503 -0.205196
H -3.185513 1.662625 1.334425
H -3.658787 -0.706525 1.533259
H -3.515677 -1.838505 0.161031
H 1.403213 1.053185 0.910099
H 3.151203 -1.196363 0.124400
H 4.954398 0.138035 1.309525
H 3.822782 1.499836 1.522502
H 3.513107 -0.063337 2.351096
H 3.020569 0.127663 -1.977866
H 4.674200 0.199557 -1.295476
H 3.575463 1.604768 -1.117869


