%chk=000219563.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219563

0 1
O 1.175671 -0.343680 -1.752472
O -5.487359 -3.891478 0.309923
O -5.071676 -3.354970 2.361469
N -1.116701 0.551963 -0.647396
N 3.508944 -1.777362 -1.230929
N -4.887400 -3.241221 1.156102
C -0.161350 1.281304 0.227864
C 1.124049 0.505952 0.459733
C 0.116309 2.640625 -0.398820
C 1.739100 -0.275269 -0.505963
C 1.735500 0.594074 1.746098
C 2.953463 -1.002390 -0.219165
C 3.528807 -0.899178 1.073185
C -1.986408 -0.416195 -0.166120
C 2.893868 -0.078300 2.050999
C -0.378741 3.791432 0.232027
C 0.844910 2.759424 -1.589866
C 4.732665 -1.638596 1.318821
C -2.708660 -1.203118 -1.113033
C -2.233742 -0.593431 1.223469
C -0.138124 5.051319 -0.323082
C 1.081176 4.021256 -2.142392
C 0.591943 5.168559 -1.510199
C -3.651077 -2.114114 -0.678440
C -3.179590 -1.509542 1.646462
C 5.274660 -2.402297 0.318275
C -3.895229 -2.275853 0.703394
C 4.624148 -2.446669 -0.962174
H -0.664279 1.434036 1.229353
H -0.842101 0.508649 -1.634519
H 1.257790 1.223086 2.500933
H 3.342494 0.003918 3.039901
H -0.956695 3.710907 1.151244
H 1.233132 1.867486 -2.086492
H 5.195679 -1.578797 2.304544
H -2.520654 -1.080531 -2.177157
H -1.679000 -0.009288 1.954091
H -0.523373 5.943039 0.169446
H 1.648693 4.109517 -3.067759
H 0.777540 6.150751 -1.941588
H 1.688360 -0.970869 -2.352594
H -4.217514 -2.723181 -1.393013
H -3.382919 -1.654450 2.714151
H 6.186366 -2.978552 0.467049
H 5.050725 -3.055767 -1.769962


%chk=000219563-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219563

0 1
O 1.219972 -0.384286 -1.777644
O -5.359211 -4.055321 0.264090
O -4.600369 -3.795932 2.405438
N -1.173677 0.690571 -0.619830
N 3.337896 -1.823876 -1.157287
N -4.602504 -3.475683 1.146421
C -0.178336 1.415168 0.195039
C 1.082020 0.580757 0.482224
C 0.124178 2.776038 -0.451518
C 1.682506 -0.254020 -0.470963
C 1.680717 0.640699 1.784728
C 2.845263 -1.031351 -0.134484
C 3.426422 -0.959270 1.177569
C -1.977030 -0.339100 -0.162531
C 2.816206 -0.093124 2.139977
C -0.411582 3.954890 0.123051
C 0.906983 2.877795 -1.630879
C 4.581625 -1.775661 1.407941
C -2.835225 -1.015815 -1.091040
C -2.005703 -0.743471 1.211758
C -0.169753 5.217414 -0.463522
C 1.143085 4.139131 -2.220933
C 0.608514 5.312511 -1.639566
C -3.690472 -2.037102 -0.669336
C -2.867003 -1.763659 1.636253
C 5.077107 -2.579832 0.375722
C -3.709554 -2.408894 0.699684
C 4.424457 -2.576083 -0.899287
H -0.651284 1.627167 1.173738
H -1.072544 0.796049 -1.630994
H 1.215387 1.299672 2.528898
H 3.236682 -0.016123 3.148318
H -1.024984 3.884831 1.030065
H 1.328698 1.974845 -2.085142
H 5.066220 -1.763498 2.390724
H -2.818943 -0.719191 -2.146278
H -1.340490 -0.274600 1.941462
H -0.588339 6.120985 -0.006761
H 1.748143 4.207110 -3.131987
H 0.797092 6.289886 -2.097410
H 1.842027 -1.064940 -2.197871
H -4.349049 -2.557036 -1.369961
H -2.897414 -2.083074 2.681501
H 5.956510 -3.213249 0.524416
H 4.799156 -3.199130 -1.718395


