%chk=000286018.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286018

0 1
O 2.230318 0.439327 0.239643
O -3.865750 1.225527 1.570194
O -7.076982 -1.229667 -0.507984
O -4.961983 -1.942262 -0.324055
N -3.989513 0.693087 -0.642092
N 0.161257 -0.647720 -0.038170
N 0.385022 1.684029 0.728642
N -1.937099 -1.637438 -0.341892
C 4.336572 -0.543216 -0.149353
C 2.864351 -0.833270 -0.180965
C -1.817965 0.705258 0.433080
C -1.220170 -0.526698 0.032555
C 5.196218 -1.316676 -0.944678
C 4.856755 0.465379 0.672629
C -3.271860 0.894144 0.562640
C 0.887799 0.460405 0.297270
C -0.956783 1.766381 0.795886
C -5.435184 0.471212 -0.592031
C 6.572731 -1.081851 -0.907450
C 6.234624 0.699607 0.698179
C 7.093573 -0.074312 -0.087811
C -5.728933 -1.013030 -0.455266
H 2.569480 -1.614455 0.545274
H 2.484431 -1.086247 -1.187610
H 4.797594 -2.097694 -1.588948
H 4.180652 1.072492 1.280055
H -1.371413 2.723881 1.151163
H -3.514591 0.433805 -1.502902
H -5.939302 0.884978 -1.497398
H -5.880386 1.015250 0.290124
H 7.241561 -1.683452 -1.520929
H 6.637139 1.487628 1.333428
H 8.166518 0.107427 -0.063943
H -1.447657 -2.503294 -0.531542
H -2.938489 -1.718077 -0.158243
H -7.323932 -2.190762 -0.398801


%chk=000286018-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286018

0 1
O 2.217037 0.595771 0.295150
O -3.933644 1.556605 1.497145
O -7.134074 -1.444628 -0.460884
O -4.903838 -2.077499 -0.352502
N -4.062761 0.560342 -0.604571
N 0.144965 -0.425145 -0.131684
N 0.343314 1.761171 0.945271
N -1.897630 -1.471368 -0.519617
C 4.350164 -0.463337 -0.187112
C 2.843329 -0.613984 -0.284725
C -1.870686 0.832211 0.427544
C -1.227958 -0.351188 -0.082833
C 5.169760 -1.395074 -0.873870
C 4.957179 0.555903 0.584417
C -3.346120 1.018458 0.508885
C 0.843187 0.628499 0.358586
C -1.014173 1.824757 0.965235
C -5.492652 0.321461 -0.530544
C 6.576505 -1.314874 -0.784613
C 6.366420 0.637570 0.669247
C 7.180720 -0.296103 -0.010787
C -5.774941 -1.178117 -0.436908
H 2.481006 -1.499011 0.273142
H 2.509416 -0.726110 -1.333447
H 4.709352 -2.185577 -1.481044
H 4.322176 1.279612 1.102537
H -1.455730 2.712978 1.429217
H -3.545593 0.230115 -1.421821
H -6.048007 0.742283 -1.387952
H -5.868605 0.821559 0.382589
H 7.198785 -2.041029 -1.319805
H 6.826620 1.432537 1.266960
H 8.272407 -0.230324 0.057424
H -1.314624 -2.259212 -0.801754
H -2.902744 -1.626416 -0.367771
H -7.299961 -2.423139 -0.380406


