%chk=000181022.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181022

0 1
O -1.006121 -0.844648 -1.495902
O 3.468645 0.441006 1.962759
N 0.409174 1.855234 0.664858
C -0.241263 1.951281 -0.683438
C 1.805861 2.408215 0.640956
C -0.249141 3.389015 -1.250032
C 1.898639 3.821013 0.018729
C 1.186337 3.922576 -1.334174
C -1.663045 1.355960 -0.673261
C 2.723482 1.401127 -0.088111
C -0.381854 2.481037 1.765196
C -1.623580 -0.155686 -0.395007
C 3.084850 0.247786 0.827953
C -3.007328 -0.714052 -0.128744
C 3.015862 -1.130345 0.249948
C -3.273578 -1.330642 1.101526
C -4.020451 -0.628517 -1.094320
C 4.069977 -2.020991 0.506209
C 1.912444 -1.548930 -0.503013
C -4.542870 -1.854703 1.363789
C -5.287473 -1.156087 -0.830579
C -5.551071 -1.768908 0.398764
C 4.029345 -3.317142 -0.012058
C 1.869496 -2.852035 -1.008823
C 2.928230 -3.733023 -0.769807
H 0.389029 1.304973 -1.362153
H 2.162315 2.473537 1.708637
H -0.866377 4.049838 -0.614614
H -0.717709 3.404809 -2.249918
H 2.958247 4.117787 -0.086213
H 1.456089 4.550252 0.725155
H 1.178034 4.975030 -1.675613
H 1.752798 3.359416 -2.101149
H -2.149328 1.552335 -1.646669
H -2.298960 1.857540 0.082315
H 3.664040 1.900829 -0.397385
H 2.252223 1.051874 -1.028478
H 0.130589 2.290265 2.723377
H -1.368179 1.993950 1.829258
H -0.537098 3.564656 1.662392
H -0.908929 -0.390398 0.436789
H -1.566447 -0.821539 -2.293950
H -2.490120 -1.408193 1.855488
H -3.826624 -0.149517 -2.051513
H 4.912958 -1.696873 1.118329
H 1.071583 -0.870416 -0.688759
H -4.744223 -2.333566 2.320974
H -6.070754 -1.089504 -1.583745
H -6.538180 -2.179367 0.603008
H 4.849631 -4.005597 0.180558
H 1.002718 -3.174237 -1.585069
H 2.894809 -4.745626 -1.168667


%chk=000181022-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181022

0 1
O -0.973824 -0.692236 -1.740553
O 4.072109 0.673973 1.528564
N 0.451943 1.926962 0.502784
C -0.271722 2.119280 -0.798336
C 1.857322 2.450566 0.453309
C -0.284959 3.600883 -1.267251
C 1.923920 3.921957 -0.059483
C 1.168187 4.118771 -1.393703
C -1.678241 1.483145 -0.771394
C 2.785108 1.479961 -0.345270
C -0.278917 2.380202 1.709177
C -1.603034 -0.040165 -0.545118
C 3.322341 0.358343 0.551998
C -2.917781 -0.736065 -0.210997
C 2.999634 -1.081069 0.281913
C -2.873611 -2.016109 0.402652
C -4.182780 -0.180312 -0.532809
C 3.786235 -2.075533 0.930208
C 1.926426 -1.484948 -0.556312
C -4.060255 -2.723957 0.687359
C -5.374451 -0.887749 -0.251127
C -5.317239 -2.161035 0.359289
C 3.515852 -3.442720 0.732481
C 1.644911 -2.857229 -0.738118
C 2.441356 -3.838195 -0.103670
H 0.303211 1.551477 -1.559384
H 2.240800 2.444756 1.491448
H -0.849641 4.228862 -0.547611
H -0.808183 3.676239 -2.241333
H 2.981371 4.234697 -0.154256
H 1.464303 4.578665 0.707440
H 1.178398 5.186828 -1.683595
H 1.682540 3.564207 -2.205753
H -2.169741 1.695702 -1.742356
H -2.303387 1.955002 0.010173
H 3.675081 2.051194 -0.673632
H 2.289908 1.093737 -1.249175
H 0.360033 2.204938 2.592219
H -1.198599 1.785694 1.850378
H -0.569187 3.458562 1.708378
H -0.854740 -0.234146 0.243881
H -1.655346 -0.722295 -2.461256
H -1.898069 -2.451716 0.650672
H -4.245832 0.810829 -0.995971
H 4.599559 -1.744291 1.584607
H 1.278880 -0.754649 -1.048954
H -4.008755 -3.708504 1.165712
H -6.344635 -0.444605 -0.503057
H -6.240572 -2.707602 0.581768
H 4.133857 -4.200889 1.226473
H 0.799759 -3.145938 -1.371785
H 2.227161 -4.902675 -0.254823


