%chk=000217844.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217844

0 1
O -1.783408 -2.317582 0.118559
O -1.797899 2.267633 -0.474281
N 2.329412 0.061589 0.077560
N -1.407075 -0.040647 -0.312910
C 0.919037 0.019172 0.574534
C 0.026775 -0.080217 -0.682800
C 3.242556 -0.804359 0.892880
C 2.829264 1.474633 -0.011185
C 2.955203 -2.279337 0.610595
C 4.020154 1.546036 -0.967951
C -2.184076 -1.186896 0.072683
C -2.192345 1.160205 -0.229437
C -3.563725 -0.631911 0.385674
C -3.568209 0.694169 0.215310
H 0.636548 0.901720 1.185299
H 0.747852 -0.870030 1.220055
H 0.236302 -1.031084 -1.225507
H 0.238821 0.758146 -1.385364
H 4.290602 -0.573873 0.593525
H 3.171437 -0.599452 1.982701
H 2.006975 2.112681 -0.408103
H 3.107084 1.895768 0.979026
H 1.962958 -2.583520 0.964732
H 2.980433 -2.483223 -0.468707
H 3.696108 -2.924401 1.092862
H 4.905211 1.043134 -0.562410
H 3.784644 1.055726 -1.922741
H 4.290538 2.585233 -1.180946
H -4.357444 -1.296343 0.690850
H -4.366533 1.408929 0.343299


%chk=000217844-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217844

0 1
O -1.767619 -2.297641 0.195913
O -1.845551 2.333943 -0.580330
N 2.338356 0.032882 0.148506
N -1.431955 0.005893 -0.301849
C 0.922654 -0.032152 0.571660
C -0.007130 -0.032365 -0.668559
C 3.245695 -0.833042 0.946642
C 2.827671 1.428389 -0.019379
C 3.082018 -2.329026 0.616314
C 3.985453 1.546766 -1.028858
C -2.194217 -1.118984 0.106169
C -2.232565 1.177904 -0.276561
C -3.584152 -0.603219 0.394925
C -3.606039 0.739290 0.173025
H 0.641977 0.816485 1.239856
H 0.747960 -0.963448 1.138552
H 0.185426 -0.941316 -1.262699
H 0.194126 0.852536 -1.296602
H 4.283681 -0.532687 0.715384
H 3.106572 -0.669384 2.045309
H 1.980336 2.040262 -0.382499
H 3.134519 1.871180 0.962124
H 2.057637 -2.688023 0.824250
H 3.291972 -2.505809 -0.452864
H 3.779618 -2.937807 1.221517
H 4.877699 0.981115 -0.704415
H 3.673469 1.154278 -2.012316
H 4.285923 2.604613 -1.146909
H -4.386049 -1.263845 0.724824
H -4.430284 1.445111 0.276675


