%chk=000221603.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221603

0 1
O 4.637063 -0.422977 0.086466
O -2.376441 0.578429 -0.104417
O 3.182680 -2.050564 -0.209000
O -5.777620 -0.267014 -0.028902
O -4.763781 1.649922 -0.114616
N 2.311335 0.139145 -0.120121
N 1.063462 -0.366295 -0.098055
N -4.779041 0.434299 -0.068512
C 4.063602 1.848443 -0.569296
C 2.598921 1.608126 -0.205523
C 4.944344 0.979467 0.311487
C 3.350761 -0.868731 -0.086906
C -1.284878 -0.302344 -0.085623
C -0.006963 0.386477 -0.127825
C -1.712354 -1.616912 -0.031467
C -3.504701 -0.261098 -0.058825
C -3.140164 -1.592281 -0.014129
H 4.244301 1.612288 -1.641013
H 4.317000 2.921961 -0.455305
H 2.352097 2.076377 0.776272
H 1.935287 2.073246 -0.971994
H 6.018505 1.014127 0.043408
H 4.812944 1.170284 1.391651
H -0.073189 1.482422 -0.181431
H -1.084663 -2.493936 -0.007934
H -3.800210 -2.445460 0.025812


%chk=000221603-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221603

0 1
O 4.706302 -0.419438 0.020813
O -2.355453 0.612729 -0.102926
O 3.219715 -2.125390 -0.333500
O -5.806930 -0.342613 0.057222
O -4.827418 1.737358 -0.086366
N 2.368695 0.081864 -0.199547
N 1.101525 -0.454793 -0.143057
N -4.775026 0.446033 -0.018101
C 4.071710 1.881653 -0.533622
C 2.585674 1.551883 -0.331701
C 4.900141 1.005554 0.403651
C 3.410199 -0.912328 -0.182644
C -1.258227 -0.276307 -0.090060
C 0.045037 0.341851 -0.165470
C -1.721967 -1.598795 -0.004281
C -3.495759 -0.195092 -0.023556
C -3.149040 -1.544716 0.038551
H 4.379930 1.687283 -1.576306
H 4.240005 2.953508 -0.326480
H 2.196396 2.044473 0.583090
H 1.987970 1.917526 -1.190206
H 5.982980 1.169261 0.301055
H 4.606440 1.135827 1.463228
H 0.050775 1.440813 -0.231154
H -1.084348 -2.479062 0.020505
H -3.851030 -2.371683 0.105063


