%chk=000228067.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228067

0 1
O -4.347513 -0.046281 0.229133
O 2.949446 -0.595019 0.261185
O 0.391989 2.244429 0.133984
O 1.589447 -2.087939 -0.531177
O 1.201764 1.175448 -1.570152
N 1.852545 -1.018773 -0.027894
N 0.773827 1.247623 -0.438796
C 0.635901 -0.098762 0.341350
C -0.664443 -0.766618 -0.132594
C -1.921991 -0.013309 0.298678
C 0.716506 0.159032 1.833068
C -3.172735 -0.620237 -0.352044
H -0.696876 -1.810297 0.259271
H -0.639957 -0.888865 -1.240185
H -1.853743 1.064913 0.049716
H -2.043973 -0.048533 1.402282
H 1.726652 0.468691 2.153851
H 0.438715 -0.727850 2.420363
H 0.036725 0.975060 2.139094
H -3.189492 -0.475181 -1.446447
H -3.288895 -1.696771 -0.118005
H -4.424199 0.900939 -0.003781


%chk=000228067-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228067

0 1
O -4.448668 0.055121 0.074721
O 3.006723 -0.423445 0.106168
O 0.777886 2.328483 0.337017
O 1.642779 -2.101231 -0.620795
O 0.842606 1.180065 -1.633310
N 1.858335 -0.956866 -0.093738
N 0.773381 1.253534 -0.354387
C 0.609627 -0.119504 0.406846
C -0.689303 -0.775590 -0.080734
C -1.960941 0.028787 0.278790
C 0.761488 0.084908 1.910494
C -3.217960 -0.644628 -0.310908
H -0.742001 -1.785028 0.365728
H -0.618788 -0.911208 -1.175421
H -1.889319 1.064072 -0.112462
H -2.092414 0.099662 1.374016
H 1.746634 0.515632 2.147132
H 0.655455 -0.887148 2.422386
H -0.016206 0.769928 2.280388
H -3.128217 -0.724905 -1.415945
H -3.341465 -1.661127 0.100125
H -4.459933 0.952188 -0.345212


