%chk=000186799.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186799

0 1
O -3.268569 1.270865 0.003246
O 4.270067 0.253549 -0.000971
N -2.133739 -0.744650 -0.000045
N 2.568895 -1.812630 -0.004127
C -0.784660 -0.285815 0.000147
C 1.582318 -0.855552 -0.001933
C 0.217993 -1.258289 -0.002099
C 1.917998 0.533938 0.000538
C -0.462338 1.095216 0.002567
C 0.864385 1.474838 0.002724
C -3.307327 0.061213 0.001512
C 3.298892 1.000964 0.000858
C -4.577942 -0.741151 0.000771
H -0.022549 -2.314505 -0.003978
H -1.258204 1.845221 0.004250
H 1.113044 2.540349 0.004598
H -2.254102 -1.761728 -0.001521
H 2.355175 -2.791489 -0.005866
H 3.557883 -1.537813 -0.003975
H 3.450022 2.093070 0.002884
H -4.676877 -1.377008 -0.889321
H -5.447658 -0.060539 0.002034
H -4.676307 -1.379553 0.889106


%chk=000186799-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186799

0 1
O -3.374375 1.326089 0.004122
O 4.347695 0.192336 -0.001040
N -2.150580 -0.684970 -0.000068
N 2.573783 -1.832037 -0.003993
C -0.803801 -0.235624 0.000209
C 1.580561 -0.878301 -0.001889
C 0.202034 -1.229305 -0.001948
C 1.937457 0.526020 0.000465
C -0.460217 1.153647 0.002520
C 0.894989 1.496771 0.002590
C -3.338280 0.064069 0.001745
C 3.325012 0.964279 0.000736
C -4.599297 -0.801222 0.000640
H -0.077243 -2.291858 -0.003719
H -1.249724 1.904411 0.004153
H 1.177124 2.557489 0.004363
H -2.270774 -1.701238 -0.001865
H 2.350623 -2.824204 -0.005663
H 3.548060 -1.490714 -0.003748
H 3.476330 2.069615 0.002674
H -4.643428 -1.446821 -0.896199
H -5.476945 -0.139590 0.002342
H -4.642604 -1.450342 0.894973


