%chk=000281712.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281712

0 1
O 2.900082 0.287624 -0.012331
O 2.819788 -1.963855 0.006675
N -1.449319 -1.165607 0.068585
C -1.308510 0.242757 0.054622
C -2.801478 -1.760086 0.108335
C -3.820609 -0.775134 -0.506642
C -2.348595 1.190222 0.048583
C -3.748925 0.649009 0.082848
C 0.077810 0.564482 0.028723
C -0.179790 -1.737207 0.048806
C 0.779791 -0.697905 0.027242
C -1.963020 2.521270 0.025962
C 0.430207 1.927621 0.008567
C 0.045653 -3.193437 0.054960
C -0.585653 2.872529 0.008699
C 2.208269 -0.907496 0.007325
C 4.364943 0.186932 -0.033602
C 4.825356 1.629768 -0.033120
H -3.066939 -1.981254 1.168568
H -2.809180 -2.723666 -0.446425
H -4.839917 -1.183135 -0.369732
H -3.653278 -0.716022 -1.602481
H -4.108509 0.646226 1.133644
H -4.440524 1.312552 -0.473695
H -2.706254 3.313603 0.020035
H 1.484825 2.204477 -0.007972
H -0.370124 -3.682290 0.946999
H -0.369535 -3.688183 -0.834487
H 1.139449 -3.412334 0.054716
H -0.330502 3.931791 -0.007032
H 4.677744 -0.377556 0.861540
H 4.650471 -0.368200 -0.943482
H 5.918892 1.697639 -0.049444
H 4.436606 2.172119 -0.905822
H 4.463473 2.162945 0.856631


%chk=000281712-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281712

0 1
O 2.932914 0.327018 -0.011066
O 2.822045 -2.003801 0.003608
N -1.455447 -1.132046 0.056398
C -1.330900 0.265395 0.045930
C -2.784978 -1.766078 0.114878
C -3.837602 -0.820802 -0.522149
C -2.399169 1.182190 0.054940
C -3.810504 0.609076 0.090520
C 0.054138 0.603929 0.024700
C -0.187603 -1.710095 0.045913
C 0.776701 -0.666597 0.025150
C -2.035829 2.543782 0.033176
C 0.388664 1.984657 0.011342
C -0.000907 -3.198395 0.053372
C -0.660838 2.929741 0.015248
C 2.220756 -0.890551 0.005981
C 4.417302 0.197349 -0.030929
C 4.983953 1.614893 -0.040184
H -3.050932 -1.976727 1.170860
H -2.755059 -2.730188 -0.422848
H -4.837469 -1.274086 -0.390967
H -3.641383 -0.753131 -1.608833
H -4.175444 0.565531 1.137752
H -4.512164 1.263652 -0.458697
H -2.814723 3.316121 0.029219
H 1.435623 2.296041 -0.003640
H -0.471647 -3.662548 0.941593
H -0.450415 -3.669161 -0.843026
H 1.075565 -3.424904 0.063513
H -0.415695 3.998069 0.001403
H 4.734268 -0.377395 0.858546
H 4.709597 -0.378804 -0.928006
H 6.088738 1.577150 -0.055838
H 4.642906 2.169673 -0.931476
H 4.668236 2.171239 0.859421


