%chk=000253158.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253158

0 1
O -3.034389 -0.992317 0.854519
O -1.605698 -0.722681 -0.954646
O 0.069599 2.051802 0.914349
O 4.093353 1.825772 -1.277846
N 0.334108 -0.724234 1.862453
N 2.068315 1.966792 -0.161954
N 3.366995 -0.056632 -0.172520
C -1.768942 -0.473571 0.444073
C -0.741969 -1.416902 1.107218
C 1.276146 -0.035761 1.015265
C -4.163338 -0.081230 0.771441
C -2.208437 0.213133 -1.873250
C 1.034512 1.368994 0.631109
C 2.402271 -0.693191 0.617559
C -5.325556 -0.880885 1.329196
C -1.449652 1.528335 -1.905709
C 3.239734 1.300879 -0.593859
H -1.667460 0.603941 0.680764
H -1.272891 -2.091692 1.823250
H -0.300843 -2.080377 0.327128
H -0.071205 -0.067617 2.546854
H -3.939242 0.819027 1.369211
H -4.307257 0.193931 -0.292931
H -2.128127 -0.342676 -2.827516
H -3.276350 0.345060 -1.609408
H 2.597243 -1.739102 0.894800
H -6.263853 -0.319699 1.276574
H -5.454189 -1.821599 0.774682
H -5.148778 -1.160648 2.376388
H -1.899278 2.234091 -2.612369
H -1.423849 2.017477 -0.920239
H -0.405707 1.375957 -2.206544
H 1.955164 2.949527 -0.451839
H 4.203771 -0.563204 -0.474199


%chk=000253158-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253158

0 1
O -3.160381 -1.077340 1.137312
O -1.718156 -0.362568 -0.656988
O 2.112630 2.506938 2.032078
O 4.831145 0.417380 -1.179987
N 0.004671 0.805296 1.550548
N 3.435441 1.449524 0.412556
N 2.639431 -0.359960 -0.836438
C -2.196104 -0.087307 0.698669
C -1.024679 -0.217249 1.693241
C 1.168648 0.645937 0.804076
C -4.408916 -1.110972 0.350383
C -2.184304 0.575084 -1.707078
C 2.242666 1.603637 1.146163
C 1.394123 -0.292058 -0.187251
C -5.344773 -2.112997 1.023942
C -1.309138 1.832282 -1.794815
C 3.718906 0.488174 -0.584287
H -2.647978 0.932899 0.723883
H -1.452076 -0.168888 2.710405
H -0.592135 -1.229553 1.564850
H 0.072416 1.552813 2.247373
H -4.858175 -0.092181 0.328886
H -4.177090 -1.416820 -0.689310
H -2.132129 -0.009517 -2.642195
H -3.245381 0.846272 -1.526885
H 0.615132 -0.971885 -0.533867
H -6.294240 -2.189470 0.463285
H -4.876494 -3.111665 1.056857
H -5.570927 -1.802993 2.058546
H -1.666996 2.491235 -2.608620
H -1.332168 2.403788 -0.849906
H -0.259223 1.562182 -1.999132
H 4.199221 2.096459 0.631375
H 2.801233 -1.065780 -1.555664


