%chk=000227991.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227991

0 1
O -4.873125 1.409341 -0.085276
O -5.297553 -0.766675 0.172932
N 3.290281 0.145785 -0.126914
N 1.991203 0.320423 -0.294305
N 1.195291 -0.562563 0.192437
C 3.938698 -1.016847 0.549618
C 4.157507 1.115259 -0.864639
C 4.089159 -2.205397 -0.394265
C 4.763898 2.131480 0.098638
C -0.208037 -0.297249 0.102978
C -2.989667 -0.010472 0.077501
C -1.034763 -1.435738 0.244925
C -0.782182 0.981538 -0.050280
C -2.415491 -1.287830 0.231787
C -2.167439 1.119397 -0.062347
C -4.455370 0.098460 0.068660
H 4.926013 -0.688262 0.939235
H 3.318065 -1.307078 1.432786
H 4.953278 0.544794 -1.394593
H 3.558704 1.639992 -1.647155
H 3.108376 -2.549695 -0.756392
H 4.697713 -1.968631 -1.273137
H 4.558162 -3.054385 0.117532
H 3.985356 2.690216 0.636962
H 5.401095 1.660509 0.856352
H 5.377684 2.863109 -0.441037
H -0.579180 -2.418891 0.367374
H -0.143597 1.857113 -0.159376
H -3.068882 -2.158861 0.340501
H -2.625100 2.106069 -0.180664
H -5.863895 1.484189 -0.091138


%chk=000227991-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227991

0 1
O -4.903558 1.312384 -0.439701
O -5.252662 -0.746972 0.574818
N 3.332273 0.170559 -0.215113
N 1.999182 0.408469 -0.273771
N 1.255633 -0.580412 0.197293
C 3.913233 -1.080717 0.329313
C 4.194231 1.262885 -0.705948
C 3.932900 -2.226230 -0.707200
C 4.791921 2.119381 0.431669
C -0.143079 -0.309490 0.135162
C -2.968688 -0.008324 0.114834
C -0.982567 -1.330333 0.664504
C -0.737774 0.869633 -0.408404
C -2.378347 -1.182320 0.655586
C -2.133198 1.013573 -0.416540
C -4.443699 0.104939 0.125574
H 4.935831 -0.843913 0.673709
H 3.302080 -1.379624 1.199407
H 5.003462 0.819442 -1.317056
H 3.570855 1.886756 -1.367613
H 2.904559 -2.478111 -1.013859
H 4.514439 -1.948818 -1.604843
H 4.394760 -3.126336 -0.262383
H 3.988170 2.598363 1.016873
H 5.407100 1.511271 1.119376
H 5.437000 2.911123 0.009346
H -0.508832 -2.227184 1.076170
H -0.091146 1.651897 -0.815671
H -3.033071 -1.960607 1.060815
H -2.597756 1.912704 -0.831504
H -5.897049 1.315111 -0.396145


