%chk=000251277.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251277

0 1
O -3.316195 0.916551 -0.870038
O 3.073898 -2.789882 0.765922
N 2.546379 -1.945224 -0.215705
C -0.580091 0.580899 -0.143997
C 0.603765 1.186058 0.620038
C -1.765833 0.308046 0.789456
C 1.771224 1.565751 -0.312411
C -3.020272 -0.174736 0.034967
C 2.399016 0.330308 -0.995818
C 2.825897 2.372069 0.455481
C -4.209529 -0.340674 0.991566
C -2.790465 -1.447614 -0.784704
C 2.874215 -0.704130 -0.015571
H -0.265970 -0.357622 -0.641356
H -0.911416 1.265331 -0.952927
H 0.951364 0.478275 1.396493
H 0.269605 2.089353 1.167499
H -1.487765 -0.437671 1.556510
H -2.023228 1.239029 1.334948
H 1.367173 2.217666 -1.129967
H 3.261742 0.644116 -1.621619
H 1.663181 -0.105901 -1.706880
H 2.406130 3.310016 0.837050
H 3.676065 2.633576 -0.183508
H 3.219088 1.820593 1.316250
H -4.457417 0.613626 1.472262
H -3.994148 -1.066778 1.781373
H -5.109813 -0.681396 0.471933
H -2.344852 -2.241334 -0.175691
H -2.104982 -1.253260 -1.619674
H -3.717668 -1.841258 -1.210208
H -4.099651 0.724809 -1.410767
H 3.485039 -0.336408 0.821362
H 2.750615 -3.702085 0.473430


%chk=000251277-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000251277

0 1
O -3.368329 0.855799 -0.994563
O 3.020815 -2.812845 0.700768
N 2.406431 -1.891620 -0.280831
C -0.554713 0.546218 -0.164235
C 0.607319 1.217148 0.603008
C -1.789118 0.332351 0.738336
C 1.817044 1.627676 -0.277679
C -3.051006 -0.197449 0.015439
C 2.440055 0.417885 -1.047757
C 2.879500 2.378662 0.561178
C -4.230987 -0.310144 1.007233
C -2.809345 -1.542500 -0.706196
C 2.919388 -0.693951 -0.147575
H -0.211293 -0.425461 -0.567777
H -0.854903 1.173978 -1.025370
H 0.960101 0.537352 1.407531
H 0.226662 2.128120 1.110491
H -1.537238 -0.368344 1.560387
H -2.062135 1.298605 1.208131
H 1.445297 2.324619 -1.058787
H 3.302319 0.791145 -1.638539
H 1.709667 0.003633 -1.765259
H 2.453262 3.302526 0.993936
H 3.753302 2.665544 -0.053862
H 3.243688 1.759452 1.402806
H -4.433423 0.672320 1.469196
H -4.012169 -1.036801 1.811609
H -5.152123 -0.646865 0.492642
H -2.454505 -2.315371 0.000419
H -2.055661 -1.429254 -1.503353
H -3.745258 -1.912659 -1.168497
H -4.182797 0.579232 -1.487815
H 3.694237 -0.487384 0.609366
H 2.571016 -3.671521 0.491319


