%chk=000240395.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240395

0 1
O -2.032208 0.310460 0.515412
O -0.758452 -0.134084 -1.340675
N 0.153847 0.821983 0.585848
C 2.471207 -0.040851 0.889354
C 2.791762 -1.365066 0.159975
C 1.560508 0.915169 0.091002
C 3.593700 -1.114242 -1.123452
C 1.528859 -2.177098 -0.138148
C 2.018686 2.372584 0.222590
C -0.848760 0.286512 -0.200668
C -3.228730 -0.243851 -0.162276
C -3.145252 -1.759027 -0.102427
C -4.362469 0.351934 0.655300
H 2.018752 -0.274469 1.872324
H 3.425598 0.467851 1.127585
H 3.433641 -1.967655 0.854319
H 1.560464 0.622880 -0.997839
H 4.512653 -0.555269 -0.924297
H 3.011006 -0.545499 -1.858813
H 3.876246 -2.058124 -1.602399
H 1.776253 -3.170303 -0.525591
H 0.895613 -1.687952 -0.894993
H 0.913349 -2.310825 0.756471
H 3.014230 2.508187 -0.216092
H 1.337583 3.053110 -0.304825
H 2.069005 2.705521 1.264508
H -0.051616 1.122592 1.533577
H -3.213515 0.130764 -1.210330
H -4.059975 -2.229492 -0.478035
H -2.307192 -2.126023 -0.714973
H -2.979525 -2.116497 0.920934
H -5.338019 0.025736 0.278831
H -4.335014 1.449182 0.630115
H -4.292935 0.059159 1.711492


%chk=000240395-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240395

0 1
O -1.982952 0.225492 0.570865
O -0.763209 0.191179 -1.457246
N 0.238709 0.693754 0.610892
C 2.662559 0.067553 0.783698
C 2.857279 -1.355852 0.184105
C 1.599130 0.980113 0.106975
C 3.449952 -1.297849 -1.246107
C 1.575660 -2.223969 0.205480
C 1.932629 2.477993 0.312178
C -0.813263 0.360242 -0.207298
C -3.216059 -0.208189 -0.168463
C -3.192535 -1.733992 -0.342947
C -4.388784 0.301337 0.673551
H 2.413706 -0.019429 1.862863
H 3.638532 0.591662 0.734360
H 3.608822 -1.855279 0.833305
H 1.557780 0.773315 -0.976948
H 4.380942 -0.700242 -1.274877
H 2.732812 -0.853209 -1.961266
H 3.687795 -2.314190 -1.611238
H 1.812000 -3.261151 -0.099008
H 0.817520 -1.834437 -0.497156
H 1.123101 -2.259066 1.213956
H 2.900733 2.726478 -0.159172
H 1.152177 3.116409 -0.137689
H 2.007375 2.726195 1.388762
H 0.043809 0.795210 1.608678
H -3.189616 0.282346 -1.159489
H -4.107591 -2.070190 -0.864891
H -2.320869 -2.040934 -0.945132
H -3.147752 -2.235934 0.640278
H -5.345317 0.041832 0.184680
H -4.340385 1.397554 0.789867
H -4.375391 -0.157455 1.678240


