%chk=000295252.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295252

0 1
O -4.291701 -1.906015 0.110116
O 1.104496 1.637788 0.004133
O -2.067146 -2.265462 0.086920
N -0.469261 -0.084753 0.042789
N 1.839641 -0.569339 0.022201
C -1.659150 0.681239 0.048614
C -2.909873 0.001335 0.071449
C -1.641817 2.095497 0.032442
C -4.102112 0.759961 0.077218
C 3.255552 -0.340023 0.002400
C -2.829770 2.809174 0.038655
C 0.856855 0.447549 0.021229
C -4.070355 2.144993 0.061068
C -2.990231 -1.462380 0.089104
C 4.080803 -1.485023 0.005781
C 3.818914 0.945972 -0.019381
C 5.466425 -1.325288 -0.012800
C 5.208492 1.079359 -0.037722
C 6.035924 -0.047754 -0.034567
C -4.478677 -3.349000 0.128369
H -0.593537 -1.124063 0.055620
H -0.682402 2.629532 0.014790
H -5.059566 0.228103 0.094912
H -2.804272 3.901176 0.026009
H -4.993708 2.719643 0.065552
H 1.549739 -1.551021 0.037969
H 3.653225 -2.483933 0.022555
H 3.182030 1.836598 -0.022080
H 6.108332 -2.206155 -0.010283
H 5.648511 2.076987 -0.054668
H 7.116866 0.067736 -0.048963
H -4.011790 -3.768466 1.025215
H -4.043857 -3.786341 -0.775980
H -5.569679 -3.441726 0.148736


%chk=000295252-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295252

0 1
O -4.177181 -1.983330 0.107134
O 1.123065 1.851257 0.004977
O -1.865905 -2.147551 0.085513
N -0.477105 0.100205 0.046224
N 1.780153 -0.415777 0.025876
C -1.687421 0.812079 0.050401
C -2.923479 0.062471 0.071640
C -1.747854 2.235922 0.034572
C -4.165007 0.759442 0.076497
C 3.198183 -0.305278 0.004491
C -2.991437 2.890217 0.039886
C 0.832141 0.619187 0.025168
C -4.208828 2.161482 0.060852
C -2.910581 -1.413277 0.087986
C 3.939335 -1.519651 0.010529
C 3.888598 0.936650 -0.022256
C 5.347930 -1.495876 -0.009870
C 5.300107 0.941331 -0.042385
C 6.040665 -0.262770 -0.036499
C -4.219848 -3.464548 0.123672
H -0.625166 -0.930048 0.059971
H -0.811403 2.795524 0.018366
H -5.085773 0.170639 0.092731
H -3.012363 3.985865 0.027530
H -5.169927 2.684823 0.064805
H 1.424370 -1.374811 0.042703
H 3.410673 -2.482140 0.031243
H 3.317833 1.866399 -0.026968
H 5.902893 -2.440606 -0.004893
H 5.824502 1.903477 -0.063045
H 7.135440 -0.242721 -0.052317
H -3.708559 -3.851839 1.020595
H -3.730398 -3.871046 -0.776953
H -5.290752 -3.709801 0.139227


