%chk=000222714.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222714

0 1
O -1.014238 3.391310 0.764843
N 2.481784 -0.211060 -0.072975
N -3.034221 2.703272 0.021829
C 3.430276 0.927927 -0.308835
C 3.066122 -1.505095 -0.561175
C 4.749487 0.672773 0.438567
C 4.380705 -1.796438 0.182388
C 5.385071 -0.651986 -0.000842
C 1.159147 0.045695 -0.734243
C 0.373307 1.060327 0.111736
C -1.049069 1.274948 -0.441160
C -1.912620 0.053016 -0.234807
C -1.659797 2.527468 0.197086
C -2.233268 -0.384037 1.060155
C -2.397595 -0.654474 -1.344563
C -3.030277 -1.516606 1.239752
C -3.194900 -1.787898 -1.158984
C -3.513851 -2.220386 0.131373
H 2.953781 1.852842 0.086106
H 3.633127 1.101723 -1.387222
H 3.243376 -1.510800 -1.657812
H 2.332933 -2.311605 -0.342061
H 4.552018 0.646788 1.529391
H 5.444123 1.513986 0.265614
H 4.807797 -2.749765 -0.176144
H 4.166533 -1.932286 1.261886
H 5.705067 -0.589899 -1.057754
H 6.299910 -0.849695 0.587279
H 1.255295 0.403585 -1.780932
H 0.590234 -0.910621 -0.775226
H 0.337561 0.717374 1.166281
H 0.904833 2.036131 0.150694
H -0.965718 1.500453 -1.539581
H -1.852468 0.156669 1.926802
H -2.151713 -0.328932 -2.353502
H -3.488111 3.490879 0.460348
H -3.639353 1.971200 -0.307784
H -3.272829 -1.854153 2.246802
H -3.566576 -2.335578 -2.023873
H -4.133585 -3.103451 0.274145


%chk=000222714-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222714

0 1
O -0.954906 3.658798 0.081794
N 2.530727 -0.208024 -0.039319
N -2.992702 2.594182 0.358601
C 3.461324 0.913276 -0.330948
C 3.121685 -1.510025 -0.445192
C 4.804250 0.731493 0.405103
C 4.452491 -1.772280 0.288985
C 5.453511 -0.621806 0.036421
C 1.182029 -0.004497 -0.620172
C 0.371403 1.079445 0.118693
C -1.049842 1.260277 -0.486677
C -1.955765 0.044772 -0.305317
C -1.653153 2.603031 0.022345
C -2.197647 -0.508850 0.982164
C -2.586508 -0.558258 -1.424603
C -3.042976 -1.628770 1.141994
C -3.433364 -1.679972 -1.269240
C -3.665612 -2.219438 0.016532
H 2.990573 1.860913 -0.016568
H 3.654919 0.988222 -1.435827
H 3.305671 -1.543221 -1.553670
H 2.393924 -2.309149 -0.208804
H 4.618940 0.768541 1.495981
H 5.478570 1.571601 0.149596
H 4.873505 -2.739514 -0.047871
H 4.248497 -1.852938 1.374309
H 5.739283 -0.611989 -1.036295
H 6.382305 -0.780213 0.616786
H 1.236078 0.259187 -1.711670
H 0.641465 -0.968132 -0.552417
H 0.309533 0.807647 1.188729
H 0.871708 2.061875 0.062550
H -0.915019 1.426443 -1.577363
H -1.717350 -0.064659 1.861976
H -2.408736 -0.145617 -2.425627
H -3.422004 3.468491 0.660465
H -3.542726 1.736531 0.333307
H -3.215215 -2.042355 2.142203
H -3.907083 -2.131681 -2.148113
H -4.319484 -3.089736 0.140760


