%chk=000198899.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198899

1 1
O 1.228457 -1.267488 -1.016592
O 3.402229 -0.996623 -1.706279
N -2.538079 -0.732033 0.185062
N 0.797560 0.681481 -0.179864
N 0.293742 -0.516659 -0.417526
C -1.264840 1.242367 1.175789
C -2.392589 0.790446 0.239867
C -0.008316 1.753557 0.459159
C -3.300320 -1.141424 -1.051406
C -3.223252 -1.258771 1.420348
C 2.091945 0.816482 -0.600322
C 2.511055 -0.424093 -1.183137
H -0.986257 0.450504 1.907367
H -1.645800 2.076449 1.817024
H -3.363755 1.241395 0.557470
H -2.211845 1.169166 -0.797352
H 0.649930 2.289885 1.196638
H -0.266551 2.513252 -0.324261
H -2.746566 -0.866604 -1.973038
H -4.304231 -0.681166 -1.108057
H -3.443948 -2.241133 -1.091747
H -2.691757 -0.957682 2.343410
H -3.259098 -2.367994 1.418292
H -4.268363 -0.904772 1.510619
H 2.714607 1.692882 -0.515708
H -1.562458 -1.167821 0.126545


%chk=000198899-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198899

1 1
O 1.081258 -1.445734 -0.898447
O 3.513707 -1.315965 -1.116320
N -2.521691 -0.604029 0.061441
N 0.734749 0.619494 -0.187390
N 0.088815 -0.537809 -0.504906
C -1.320171 1.443671 1.098006
C -2.580195 0.894296 0.384110
C -0.089650 1.792599 0.224734
C -3.448212 -0.963430 -1.083960
C -2.797409 -1.466260 1.278438
C 2.083913 0.579070 -0.344853
C 2.488149 -0.717752 -0.814969
H -1.014069 0.795971 1.940330
H -1.631330 2.398948 1.560423
H -3.471244 1.053238 1.015492
H -2.744367 1.425203 -0.570232
H 0.582838 2.451402 0.798082
H -0.390537 2.331337 -0.692357
H -3.133417 -0.423030 -1.990079
H -4.482939 -0.688216 -0.824358
H -3.389757 -2.046988 -1.268816
H -2.123573 -1.179926 2.099605
H -2.616802 -2.520372 1.018026
H -3.845147 -1.334478 1.592081
H 2.733293 1.422652 -0.136102
H -1.494714 -0.770290 -0.245679


