%chk=000282838.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282838

0 1
O -3.736790 0.821922 0.108661
O -2.998539 -1.318254 0.100439
N 0.485283 1.127357 -0.739540
C 2.234118 -0.407196 0.076673
C 1.255681 -1.462415 0.140585
C -0.393093 0.123964 -0.671003
C 1.802875 0.875012 -0.369570
C -0.041778 -1.191963 -0.233852
C -1.795282 0.440294 -1.121749
C 3.606697 -0.573913 0.436005
C 1.644481 -2.825567 0.604854
C 2.737304 1.960145 -0.449266
C 4.486000 0.477246 0.352570
C 4.045864 1.757972 -0.094700
C -2.857489 -0.169574 -0.248636
C -4.892306 0.460706 0.932151
C -5.945347 -0.211286 0.076786
H -0.821386 -1.957952 -0.192694
H -1.937697 1.551766 -1.183720
H -1.933887 0.076551 -2.167821
H 3.946223 -1.550750 0.778507
H 2.042900 -2.801872 1.630292
H 0.796763 -3.526634 0.611292
H 2.417599 -3.265868 -0.042096
H 2.372435 2.928784 -0.794266
H 5.532276 0.351929 0.626097
H 4.770143 2.570620 -0.148370
H -4.544234 -0.179498 1.762041
H -5.198533 1.456327 1.302835
H -6.879515 -0.357317 0.631997
H -6.177346 0.380436 -0.817993
H -5.607519 -1.201272 -0.265410


%chk=000282838-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282838

0 1
O -3.687473 0.818143 0.038751
O -3.062935 -1.429285 0.033002
N 0.443207 1.041040 -0.816565
C 2.250256 -0.420664 0.089007
C 1.335866 -1.540875 0.106136
C -0.381349 -0.023664 -0.792605
C 1.752322 0.855747 -0.382925
C 0.028367 -1.322982 -0.338731
C -1.797131 0.217221 -1.315727
C 3.615763 -0.510227 0.513312
C 1.777992 -2.906804 0.588684
C 2.628152 1.986941 -0.412085
C 4.451752 0.609917 0.474866
C 3.955094 1.867794 0.009256
C -2.886278 -0.250201 -0.358869
C -4.819632 0.497744 0.967396
C -6.061709 0.076702 0.177433
H -0.708256 -2.132108 -0.332379
H -1.911312 1.289687 -1.526508
H -1.932887 -0.347498 -2.259519
H 4.008265 -1.467788 0.872016
H 2.136719 -2.868483 1.634655
H 0.946601 -3.628838 0.541595
H 2.609280 -3.302638 -0.025183
H 2.216985 2.934450 -0.773625
H 5.494048 0.527913 0.802696
H 4.620539 2.737783 -0.015524
H -4.491244 -0.298934 1.657640
H -4.975419 1.440263 1.515712
H -6.911810 -0.069301 0.869509
H -6.343194 0.851860 -0.555977
H -5.884676 -0.873216 -0.354345


