%chk=000256153.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256153

0 1
O 1.917045 2.639011 -1.110822
O -1.645844 2.307314 -1.518633
O -0.035129 2.675841 2.642352
O 3.860911 -1.459118 2.045761
O -5.545832 -0.298724 -0.385004
O 5.473799 -2.384884 0.268333
O -4.645511 -2.921291 0.471693
N 0.187097 1.083383 -0.709741
C -0.013606 2.241114 0.237084
C 1.485764 1.292770 -1.424541
C -1.040235 0.989853 -1.552162
C 1.274484 3.087635 0.105058
C -1.289705 2.959882 -0.276376
C -0.185077 1.654955 1.653574
C 2.533698 0.297880 -0.961098
C -1.983360 -0.051872 -0.978753
C 2.637936 -0.088708 0.389475
C -3.351108 0.233528 -0.903876
C 3.419313 -0.212956 -1.909748
C -1.492828 -1.297344 -0.569798
C 3.629728 -0.982713 0.776222
C -4.241752 -0.731982 -0.413300
C 4.423667 -1.120601 -1.534237
C -2.370729 -2.270104 -0.083417
C 4.531737 -1.504418 -0.201614
C -3.738787 -1.992448 -0.003922
C 3.037859 -0.922660 3.111065
C -6.561986 -1.240768 0.045323
H 1.385475 1.303091 -2.537025
H -0.846496 0.808167 -2.634974
H 1.105488 4.162829 -0.058500
H 1.976478 2.936614 0.943439
H -2.150909 2.866964 0.403681
H -1.133567 4.012444 -0.562260
H 0.644804 0.947413 1.887389
H -1.149255 1.130716 1.772824
H -0.818750 3.260915 2.660639
H 1.930726 0.313449 1.119298
H -3.735167 1.205444 -1.226796
H 3.351499 0.089866 -2.953801
H -0.422968 -1.507802 -0.619922
H 5.108701 -1.510814 -2.281827
H -1.989004 -3.238155 0.231796
H 6.074473 -2.689388 -0.458147
H -4.192617 -3.769171 0.707835
H 1.991770 -1.202925 2.962565
H 3.167696 0.160521 3.190903
H 3.460233 -1.432305 3.987884
H -6.382354 -1.537268 1.084007
H -6.570301 -2.114122 -0.614542
H -7.476006 -0.645255 -0.056562


%chk=000256153-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256153

0 1
O 1.736688 2.561384 -1.656974
O -1.593460 2.039939 -1.762697
O -0.158574 3.252727 2.287717
O 3.696578 -2.089495 1.659219
O -5.660521 -0.175673 0.031180
O 6.068433 -1.717111 0.467056
O -4.810493 -2.490435 1.541132
N 0.244295 0.944927 -0.746364
C 0.064290 2.239809 0.025443
C 1.464616 1.096215 -1.588019
C -1.027183 0.697256 -1.457465
C 1.358577 3.037018 -0.313287
C -1.237423 2.870818 -0.597531
C -0.077828 1.986018 1.539536
C 2.682485 0.358200 -1.028171
C -2.011693 -0.142695 -0.634844
C 2.577215 -0.523792 0.073909
C -3.392372 0.156610 -0.657591
C 3.939885 0.550875 -1.642033
C -1.566409 -1.272669 0.091136
C 3.709056 -1.208377 0.570343
C -4.331712 -0.626122 0.050228
C 5.076029 -0.131621 -1.156215
C -2.491944 -2.068885 0.796896
C 4.974937 -1.011285 -0.056546
C -3.868827 -1.747560 0.798980
C 2.414670 -2.293033 2.333795
C -6.734142 -1.163819 -0.208710
H 1.263618 0.791187 -2.631457
H -0.835799 0.221905 -2.436418
H 1.209516 4.123543 -0.379608
H 2.157800 2.813577 0.421405
H -2.070372 2.862258 0.138535
H -1.082560 3.892851 -0.976019
H 0.829938 1.490692 1.920694
H -0.953567 1.336982 1.740071
H -1.070064 3.629939 2.202355
H 1.592146 -0.653084 0.529112
H -3.757655 1.015677 -1.227944
H 4.033836 1.248055 -2.480540
H -0.500973 -1.520659 0.104658
H 6.053326 0.023149 -1.632686
H -2.142707 -2.940931 1.367035
H 6.889144 -1.498453 -0.041490
H -4.358478 -3.208933 2.049297
H 1.663159 -2.736748 1.650145
H 2.019798 -1.344722 2.749292
H 2.632117 -2.995052 3.151977
H -6.773161 -1.913514 0.597217
H -6.583366 -1.664600 -1.184563
H -7.659373 -0.568542 -0.234386


