%chk=000228471.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228471

0 1
O -2.151331 0.041844 0.356541
O 0.707803 -2.890894 -0.774162
O -2.781360 1.356078 -1.408324
N 0.061200 -0.788202 -0.171426
N -0.204296 1.432962 0.500387
C 1.369813 -0.198614 -0.097136
C 1.183445 1.167583 0.309643
C -0.820300 0.289555 0.216878
C 2.640270 -0.723280 -0.340939
C 2.285510 2.015178 0.465426
C -0.218327 -2.157911 -0.520425
C 3.721872 0.140166 -0.178699
C 3.548381 1.483184 0.216245
C -1.659427 -2.540865 -0.545610
C -3.107153 0.792285 -0.411179
C -4.406177 0.609031 0.273702
H 2.764694 -1.764006 -0.646033
H 2.142901 3.050568 0.770326
H 4.731198 -0.229381 -0.362082
H 4.428126 2.116802 0.327642
H -2.195199 -2.241928 0.371271
H -1.766014 -3.632887 -0.655751
H -2.187369 -2.073102 -1.391454
H -4.381464 -0.183710 1.041966
H -5.208335 0.370481 -0.444022
H -4.699058 1.540664 0.794213


%chk=000228471-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228471

0 1
O -2.163573 0.077732 0.510641
O 0.719680 -2.905404 -0.747058
O -2.733255 1.228141 -1.466054
N 0.064891 -0.779358 -0.085019
N -0.183260 1.423473 0.580151
C 1.377951 -0.204309 -0.069166
C 1.191442 1.156146 0.335665
C -0.800911 0.286004 0.324481
C 2.652165 -0.728148 -0.361364
C 2.289015 2.031082 0.453045
C -0.227141 -2.134022 -0.450283
C 3.744334 0.162259 -0.238657
C 3.570408 1.516148 0.160036
C -1.678240 -2.573555 -0.478571
C -3.097595 0.723791 -0.399454
C -4.479534 0.637717 0.189555
H 2.783657 -1.766395 -0.666866
H 2.136852 3.069535 0.760336
H 4.752544 -0.205084 -0.458758
H 4.446241 2.168772 0.240189
H -2.187493 -2.371908 0.477745
H -1.691161 -3.651788 -0.694374
H -2.232927 -2.041451 -1.272631
H -4.695032 -0.390163 0.526394
H -5.223422 0.961884 -0.551781
H -4.536234 1.290502 1.078795


