%chk=000245880.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245880

0 1
O 0.376520 2.249729 -0.000372
N 0.578208 1.021780 -0.000173
C -0.162017 -1.320768 0.000068
C -1.479557 -2.059548 0.000141
C -0.419991 0.106697 -0.000086
C -1.868373 0.325017 -0.000146
C -2.509310 -0.952190 -0.000005
C 1.110067 -1.805728 0.000133
C 2.193929 -0.863050 0.000000
C 1.929846 0.531298 -0.000161
C -2.605705 1.498846 -0.000298
C -3.889393 -1.041382 -0.000014
C 3.555861 -1.287363 0.000008
C 2.999959 1.472650 -0.000316
C -4.008985 1.397574 -0.000307
C -4.637568 0.153065 -0.000167
C 4.578800 -0.366018 -0.000138
C 4.301093 1.027858 -0.000306
H -1.581376 -2.714268 0.887986
H -1.581352 -2.714474 -0.887554
H 1.328604 -2.869524 0.000263
H -2.101853 2.467816 -0.000396
H -4.394392 -2.003227 0.000095
H 3.768229 -2.355889 0.000124
H 2.750304 2.540022 -0.000420
H -4.606706 2.308047 -0.000423
H -5.725056 0.095919 -0.000180
H 5.619267 -0.694079 -0.000140
H 5.129947 1.734491 -0.000414


%chk=000245880-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245880

0 1
O 0.331429 2.296629 -0.000415
N 0.585260 0.984685 -0.000225
C -0.161695 -1.356631 0.000047
C -1.497421 -2.092748 0.000142
C -0.425298 0.052917 -0.000119
C -1.860885 0.309180 -0.000155
C -2.522112 -0.960877 0.000003
C 1.137443 -1.845692 0.000099
C 2.219463 -0.896262 -0.000026
C 1.940573 0.517998 -0.000188
C -2.598773 1.518143 -0.000307
C -3.924331 -1.028409 0.000009
C 3.595285 -1.292224 0.000008
C 2.980023 1.482367 -0.000311
C -4.010211 1.435736 -0.000299
C -4.668595 0.179959 -0.000144
C 4.622302 -0.341476 -0.000112
C 4.314038 1.052765 -0.000272
H -1.601788 -2.745144 0.888682
H -1.601791 -2.745365 -0.888234
H 1.353722 -2.918610 0.000222
H -2.071830 2.474409 -0.000426
H -4.441681 -1.995010 0.000127
H 3.831914 -2.362839 0.000133
H 2.699552 2.538276 -0.000433
H -4.604506 2.356328 -0.000415
H -5.763883 0.142272 -0.000140
H 5.668333 -0.666520 -0.000081
H 5.124462 1.789443 -0.000366


