%chk=000287385.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287385

0 1
O -4.377265 -1.263438 -2.332514
O 5.592646 -1.618058 -0.380833
O 5.440023 0.515110 -0.064003
N -2.839722 -0.232463 0.043047
N -0.677239 -1.096476 -0.134770
N 4.947362 -0.594948 -0.213134
C -3.444370 -1.590805 -0.073047
C -4.870943 -1.570473 0.503588
C -1.477289 -0.021505 0.051179
C -0.953626 1.343540 0.238393
C 0.451714 1.516631 0.222538
C 1.310536 0.358461 0.027483
C -3.453032 -2.034409 -1.556457
C 0.697302 -0.921555 -0.143710
C -4.896321 -1.376208 2.014058
C -1.792529 2.467034 0.432353
C 0.983348 2.820624 0.399178
C 2.714675 0.445797 0.001482
C 1.508269 -2.083334 -0.336642
C 3.483647 -0.698923 -0.188035
C -1.254811 3.729449 0.603025
C 0.146408 3.904914 0.585284
C 2.876624 -1.974527 -0.358388
H -2.805064 -2.319555 0.502815
H -5.480886 -0.797007 -0.007329
H -5.370400 -2.527723 0.240982
H -3.473973 0.545954 0.199916
H -2.442354 -1.975262 -2.001662
H -3.838809 -3.066530 -1.659888
H -4.446924 -0.425781 2.321469
H -4.349927 -2.173146 2.534781
H -5.925364 -1.388495 2.394882
H -2.875623 2.338642 0.448556
H 2.066058 2.962231 0.387159
H 3.211945 1.416841 0.130539
H 1.010437 -3.046919 -0.463338
H -1.901590 4.592931 0.751862
H 0.561820 4.905074 0.720433
H 3.520245 -2.849712 -0.504361
H -4.015797 -0.369180 -2.494592


%chk=000287385-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287385

0 1
O -4.271633 -1.143997 -2.418761
O 5.647819 -1.697569 -0.405016
O 5.493453 0.549668 -0.032722
N -2.851403 -0.267277 0.023092
N -0.691845 -1.102402 -0.172753
N 4.960211 -0.617793 -0.212308
C -3.454216 -1.616353 -0.096514
C -4.864677 -1.616247 0.534456
C -1.491166 -0.036402 0.023516
C -0.978083 1.332813 0.230345
C 0.446945 1.523343 0.231865
C 1.315723 0.359932 0.026019
C -3.484520 -2.062347 -1.581508
C 0.683634 -0.924577 -0.171108
C -4.882769 -1.290258 2.043616
C -1.833938 2.456836 0.422618
C 0.958221 2.839551 0.433281
C 2.729321 0.435450 0.008661
C 1.495965 -2.084354 -0.378575
C 3.491170 -0.725694 -0.198418
C -1.307669 3.741705 0.617595
C 0.100595 3.931215 0.623733
C 2.887694 -1.999309 -0.394679
H -2.795642 -2.324294 0.443777
H -5.513751 -0.917815 -0.031539
H -5.295615 -2.622864 0.374805
H -3.483450 0.503332 0.234244
H -2.448094 -2.161174 -1.956685
H -3.997077 -3.035506 -1.664699
H -4.492690 -0.277815 2.260375
H -4.263337 -2.008513 2.612143
H -5.911871 -1.340343 2.442463
H -2.924195 2.343665 0.418750
H 2.038843 3.008489 0.439685
H 3.266143 1.376283 0.152523
H 0.981022 -3.038086 -0.523636
H -1.978111 4.594913 0.763226
H 0.516558 4.932620 0.775912
H 3.523834 -2.873677 -0.552204
H -3.762196 -0.298352 -2.503277


