%chk=000282673.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282673

0 1
O 4.518815 1.268194 0.287000
O 5.608826 -1.379880 0.418621
O -6.388028 -0.148569 0.216524
N 0.171615 1.752226 -1.889911
C 1.465554 -0.851804 0.521080
C -2.251566 0.042978 -0.073696
C 2.264294 0.304078 0.434963
C 0.000509 -0.767333 0.561845
C 3.652171 0.192981 0.378056
C -0.775485 0.050579 -0.177561
C 2.073733 -2.114142 0.584549
C 4.266904 -1.089826 0.435399
C 3.463813 -2.234350 0.541315
C -2.961234 -1.163908 -0.239817
C -2.948776 1.230394 0.189270
C -5.025894 0.019731 0.136690
C -4.344948 -1.187177 -0.135954
C -4.341529 1.230901 0.300660
C -0.243947 0.988293 -1.126836
C 3.944847 2.546956 -0.087398
C 6.543091 -0.285355 0.235235
C -7.203445 1.020905 0.473583
H 1.792645 1.284718 0.425378
H -0.475441 -1.463267 1.266199
H 1.465090 -3.014464 0.657553
H 3.944960 -3.211624 0.583894
H -2.418513 -2.084399 -0.459548
H -2.401923 2.166839 0.311217
H -4.914459 -2.105606 -0.262591
H -4.866708 2.157444 0.506919
H 3.377311 2.459763 -1.020280
H 4.842914 3.160793 -0.227821
H 3.328207 2.933093 0.728877
H 7.505866 -0.808164 0.253009
H 6.452422 0.427339 1.062738
H 6.363719 0.205043 -0.726630
H -7.088052 1.750028 -0.333508
H -6.958856 1.447451 1.450407
H -8.214404 0.591743 0.473669


%chk=000282673-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282673

0 1
O 4.682402 1.249553 0.106029
O 5.718994 -1.401458 0.674237
O -6.533565 -0.341106 0.081816
N 0.026234 2.808912 -0.236208
C 1.508635 -0.774901 0.432995
C -2.309278 0.180669 0.124253
C 2.390053 0.324782 0.204367
C 0.050907 -0.707874 0.389223
C 3.787965 0.178478 0.272174
C -0.827124 0.342887 0.153973
C 2.096412 -2.040267 0.735314
C 4.361723 -1.108567 0.548110
C 3.489373 -2.197482 0.786572
C -2.930497 -1.100078 0.016491
C -3.161363 1.315398 0.198325
C -5.155864 -0.089452 0.099933
C -4.325495 -1.237000 0.008670
C -4.566366 1.195002 0.189400
C -0.345553 1.682966 -0.058884
C 4.108192 2.579322 -0.143928
C 6.739808 -0.646852 -0.082600
C -7.433794 0.813021 0.164229
H 1.975514 1.309074 -0.012392
H -0.427637 -1.675706 0.589977
H 1.449265 -2.905195 0.921210
H 3.946514 -3.166544 1.007224
H -2.322228 -2.004508 -0.088186
H -2.720858 2.316056 0.272043
H -4.799075 -2.219276 -0.080983
H -5.180140 2.098267 0.252362
H 3.531003 2.598021 -1.087500
H 4.975124 3.251523 -0.221614
H 3.457498 2.897696 0.691927
H 7.660279 -1.237069 0.045356
H 6.862365 0.369288 0.320680
H 6.469807 -0.588862 -1.152533
H -7.288673 1.497381 -0.693970
H -7.288677 1.367839 1.111324
H -8.447783 0.388666 0.133685


