%chk=000187837.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187837

0 1
O 2.024343 2.095574 -1.033920
O 2.177192 2.206537 1.201852
N -0.293866 -2.102570 0.034844
N 1.778665 -0.795010 0.185791
N 1.814120 -3.163928 0.297606
C -2.610459 1.388562 -0.480745
C -3.257113 0.173219 0.192278
C -1.175490 1.596245 0.022656
C -2.497134 -1.110732 -0.156541
C -0.382858 0.325563 0.045068
C -1.010154 -0.953500 -0.010236
C 1.014280 0.325261 0.140495
C 1.086744 -1.994869 0.152492
C 1.798536 1.606334 0.229432
H -3.210202 2.297746 -0.286329
H -2.607086 1.253969 -1.580448
H -4.314535 0.078107 -0.119457
H -3.273771 0.314701 1.291427
H -1.195810 2.023410 1.050086
H -0.668286 2.352718 -0.614066
H -2.715603 -1.418338 -1.204323
H -2.855672 -1.956730 0.470833
H 1.363701 -4.044207 0.096348
H 2.819268 -3.125040 0.210946
H 2.575291 2.926479 -1.027490


%chk=000187837-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187837

0 1
O 3.067010 1.574946 -0.408272
O 1.288021 2.792600 0.429912
N -0.277490 -2.071152 0.002005
N 1.765609 -0.737612 0.007797
N 1.843788 -3.077218 0.020725
C -2.759353 1.346999 -0.451314
C -3.321547 0.136500 0.323032
C -1.297014 1.630636 -0.039124
C -2.525780 -1.133487 -0.041134
C -0.430017 0.377857 -0.019409
C -1.021563 -0.928252 -0.014429
C 0.998060 0.391446 0.000759
C 1.088396 -1.928167 0.008167
C 1.754593 1.691264 0.041679
H -3.369611 2.250066 -0.263207
H -2.814228 1.140891 -1.539456
H -4.392448 -0.016322 0.093366
H -3.248363 0.330968 1.411625
H -1.278241 2.092372 0.968001
H -0.850353 2.391927 -0.702899
H -2.800413 -1.466773 -1.063253
H -2.768624 -1.979116 0.627191
H 1.375609 -3.978972 0.021502
H 2.857252 -3.000605 0.023522
H 3.500808 2.468702 -0.328187


