%chk=000258512.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258512

0 1
O 0.399540 -2.221361 -1.663510
N -1.898964 0.631384 -0.682867
N 2.427817 0.666491 0.347083
N -3.351091 0.462279 1.050214
N 2.256207 -1.599730 -0.476830
N 0.815064 2.355232 -0.146621
N 4.246332 -0.879227 0.624573
C -0.824067 0.328720 -1.650437
C 0.485195 0.056538 -0.971595
C -2.415381 -0.208991 0.328778
C 1.191212 1.006630 -0.270872
C -2.555223 1.875148 -0.565952
C 0.988058 -1.324740 -1.101005
C -1.985737 -1.604138 0.539892
C -3.442639 1.742675 0.500563
C 2.931885 -0.665328 0.144086
H -1.127456 -0.574263 -2.250093
H -0.727859 1.167490 -2.377700
H -2.397594 2.691068 -1.238716
H 3.046384 1.403967 0.686271
H -1.634351 -2.092831 -0.386922
H -1.162810 -1.665997 1.268822
H -2.815141 -2.212706 0.939551
H -4.131380 2.467407 0.897544
H -0.169606 2.565119 -0.305115
H 1.191519 2.886729 0.628501
H 4.444357 -0.557065 1.565131
H 4.585132 -1.833999 0.475926


%chk=000258512-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258512

0 1
O 0.546153 -2.255040 -1.888472
N -1.906375 0.661317 -0.722776
N 2.392357 0.551762 0.432148
N -3.419058 0.611124 0.963647
N 2.451682 -1.569734 -0.704111
N 0.604683 2.092623 0.283987
N 4.273226 -0.875148 0.597905
C -0.808924 0.256566 -1.638795
C 0.507827 -0.038491 -0.951691
C -2.468855 -0.101163 0.305283
C 1.132545 0.873878 -0.108972
C -2.534441 1.922211 -0.705927
C 1.134968 -1.352681 -1.211136
C -2.052420 -1.504426 0.623290
C -3.462550 1.865081 0.337793
C 3.011858 -0.659106 0.068717
H -1.093536 -0.663600 -2.180726
H -0.702331 1.070161 -2.381212
H -2.325229 2.678289 -1.460297
H 2.744576 1.089232 1.226953
H -1.885376 -2.107705 -0.286567
H -1.109582 -1.532278 1.201959
H -2.841486 -1.973663 1.230929
H -4.159704 2.633460 0.665081
H -0.391250 2.279741 0.149305
H 1.178697 2.811848 0.717132
H 4.849574 -0.129280 0.979578
H 4.702376 -1.768478 0.365676


