%chk=000220481.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220481

0 1
O 1.621812 2.289781 0.303230
N 0.680150 0.193168 0.343135
N -0.351229 -1.980704 0.358532
N -0.674135 2.205469 -0.108724
N -3.852652 -1.371017 -0.300919
C 2.031005 -0.384613 0.611036
C 2.663067 -0.956205 -0.666951
C -0.444952 -0.611840 0.213165
C 3.982647 -1.650700 -0.351961
C 0.590609 1.684661 0.172375
C -1.696007 0.007473 -0.064607
C -1.738400 1.425220 -0.217361
C -2.881146 -0.748598 -0.194652
H 1.973242 -1.141124 1.420971
H 2.675369 0.443530 1.010363
H 1.975735 -1.655207 -1.179626
H 2.834518 -0.131527 -1.392815
H 3.856271 -2.498372 0.330042
H 4.450898 -2.036464 -1.267192
H 4.704995 -0.962436 0.106711
H -2.700296 1.919067 -0.439819
H -1.173686 -2.564886 0.284669
H 0.522785 -2.447676 0.540398


%chk=000220481-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220481

0 1
O 1.717946 2.244415 0.181388
N 0.649924 0.156986 0.319992
N -0.415896 -1.976012 0.361217
N -0.617648 2.224979 -0.110766
N -3.900931 -1.422983 -0.250269
C 1.983242 -0.442132 0.596533
C 2.684702 -0.974687 -0.676330
C -0.482479 -0.615398 0.211217
C 4.059209 -1.588818 -0.336852
C 0.621922 1.631244 0.121694
C -1.729251 0.034415 -0.049823
C -1.711993 1.456420 -0.187613
C -2.916628 -0.742406 -0.161820
H 1.878999 -1.230082 1.368738
H 2.591659 0.370684 1.025768
H 2.050992 -1.723437 -1.191950
H 2.812754 -0.128938 -1.375871
H 3.964205 -2.447079 0.355552
H 4.564384 -1.948526 -1.250143
H 4.719757 -0.841540 0.139266
H -2.658938 1.977017 -0.374296
H -1.277085 -2.518838 0.294744
H 0.461756 -2.468286 0.499625


