%chk=000255404.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255404

0 1
O -0.453916 0.766778 0.521290
O 4.162345 1.046278 0.062808
O 3.154917 -0.384134 -1.376852
N -5.807408 -0.771855 0.163414
C 0.622774 0.014354 -0.108826
C 1.861957 0.784313 0.342370
C -1.746952 0.304612 0.344811
C 3.073315 0.379140 -0.443275
C -2.123268 -0.785480 -0.444308
C -2.695112 1.070687 1.054433
C -4.439516 -0.367698 0.170018
C -3.478194 -1.118959 -0.529439
C -4.037599 0.733396 0.963456
C 5.471098 0.790871 -0.542954
C 6.011760 -0.537953 -0.060023
H 2.037549 0.649190 1.433590
H 1.682809 1.882160 0.238865
H 0.488545 0.037455 -1.205795
H 0.608563 -1.024170 0.263479
H -1.393285 -1.375835 -0.990005
H -2.358201 1.909863 1.660214
H -3.780600 -1.972306 -1.132907
H -4.779415 1.308853 1.513880
H 5.362893 0.833668 -1.641285
H 6.042607 1.659423 -0.167010
H 7.051843 -0.685934 -0.374278
H 5.979189 -0.614457 1.034435
H 5.424024 -1.377018 -0.462714
H -6.089405 -1.297996 -0.653332
H -6.468718 -0.030449 0.353942


%chk=000255404-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255404

0 1
O -0.471860 0.848411 0.645944
O 4.252955 1.049295 -0.032909
O 3.093093 -0.526083 -1.308626
N -5.860208 -0.780966 -0.005532
C 0.592004 0.244146 -0.162563
C 1.885664 0.924656 0.290118
C -1.789997 0.383954 0.422372
C 3.097712 0.384184 -0.445577
C -2.146441 -0.613856 -0.515242
C -2.795332 0.988102 1.214093
C -4.518508 -0.400251 0.133023
C -3.498698 -0.999093 -0.655153
C -4.140132 0.603559 1.073415
C 5.541250 0.604724 -0.653735
C 6.131497 -0.580761 0.114703
H 2.029458 0.781471 1.376994
H 1.820605 2.016736 0.133231
H 0.407572 0.417961 -1.241646
H 0.639796 -0.849823 0.008752
H -1.391886 -1.099276 -1.141660
H -2.504267 1.758490 1.935280
H -3.761485 -1.773869 -1.386020
H -4.906470 1.082577 1.695268
H 5.350843 0.344457 -1.709809
H 6.179878 1.500060 -0.589934
H 7.122195 -0.839573 -0.303106
H 6.261516 -0.332813 1.182245
H 5.480482 -1.466843 0.028661
H -6.132683 -1.494429 -0.673910
H -6.583955 -0.348347 0.559325


