%chk=000251432.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251432

0 1
O 4.454656 -0.550972 0.690975
N -1.550555 1.495234 -0.264769
N -2.268002 -0.637202 -1.051738
C -0.455206 1.469875 -1.279607
C 0.840030 0.895156 -0.763380
C -2.329987 0.334358 -0.071313
C 1.038685 -0.491111 -0.750279
C 1.856962 1.747071 -0.294659
C -1.223755 2.300890 0.941404
C 2.232553 -1.040765 -0.273172
C 3.054008 1.227705 0.183871
C 3.227792 -0.172191 0.189732
C -3.243113 0.223942 1.015456
C -4.103643 -0.866340 1.061590
C -3.127462 -1.682075 -0.975875
C -4.060261 -1.841698 0.057578
C 4.757775 -1.965656 0.738851
H -0.316423 2.517881 -1.631688
H -0.807202 0.894651 -2.172972
H 0.248908 -1.153846 -1.116798
H 1.709842 2.826831 -0.308180
H -0.775476 3.258796 0.629422
H -0.515755 1.794092 1.618918
H -2.144539 2.538326 1.501315
H 2.367979 -2.116384 -0.269690
H 3.853017 1.868213 0.547939
H -3.278182 0.985017 1.788216
H -4.814290 -0.963149 1.883159
H -3.043785 -2.417418 -1.785623
H -4.726185 -2.696152 0.078671
H 4.757467 -2.389084 -0.269580
H 4.055664 -2.482542 1.399153
H 5.769784 -1.964051 1.164271


%chk=000251432-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251432

0 1
O 4.934530 -0.378284 0.254449
N -1.431624 1.096857 0.106617
N -2.570938 -0.535180 -1.167042
C -0.456815 1.268961 -0.993554
C 0.955092 0.819012 -0.632725
C -2.512437 0.230195 -0.022806
C 1.191503 -0.483743 -0.131305
C 2.067594 1.680123 -0.814768
C -1.268495 1.913243 1.314281
C 2.495551 -0.927159 0.179721
C 3.376733 1.256370 -0.513915
C 3.594200 -0.051244 -0.015577
C -3.524986 0.130386 0.989850
C -4.584132 -0.774068 0.800126
C -3.610738 -1.396032 -1.322480
C -4.644487 -1.563885 -0.375525
C 5.212178 -1.723996 0.759211
H -0.438147 2.334214 -1.302606
H -0.849342 0.673397 -1.836327
H 0.341709 -1.160776 0.013702
H 1.909647 2.694599 -1.202529
H -0.294664 2.425710 1.266288
H -1.270879 1.291466 2.230420
H -2.065208 2.679724 1.411924
H 2.642910 -1.941620 0.562673
H 4.239555 1.914820 -0.653590
H -3.486065 0.748957 1.889716
H -5.364354 -0.859320 1.565119
H -3.603913 -1.976091 -2.253602
H -5.456419 -2.274491 -0.552314
H 4.897532 -2.500236 0.034405
H 4.712682 -1.902591 1.731787
H 6.303527 -1.761914 0.891571


