%chk=000228488.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228488

0 1
O 0.891795 -0.229101 0.336262
O -0.982988 2.130532 1.590709
O -0.957958 2.566696 -0.610751
N -0.401477 -0.666724 0.183757
C 3.150223 -0.811838 0.108631
C 1.790168 -1.412190 0.315483
C -2.725769 -0.100729 0.005382
C 3.338230 0.194466 -0.849788
C 4.237677 -1.273283 0.864901
C -1.298210 0.272135 0.173991
C -3.472778 0.490969 -1.025995
C -3.318681 -1.031611 0.870090
C 4.611226 0.734262 -1.052138
C 5.509554 -0.735383 0.650984
C 5.697931 0.268020 -0.305555
C -4.816296 0.146950 -1.186116
C -4.665411 -1.367095 0.701246
C -5.413444 -0.779978 -0.323741
C -1.054187 1.754890 0.276028
H 1.669229 -1.929609 1.282375
H 1.497471 -2.085796 -0.511144
H 2.485896 0.558868 -1.425250
H 4.096773 -2.047439 1.616843
H -3.003727 1.212902 -1.697839
H -2.731191 -1.489977 1.665574
H 4.755064 1.519189 -1.793497
H 6.355396 -1.096521 1.234019
H 6.689697 0.686895 -0.466971
H -5.399927 0.601898 -1.985599
H -5.130696 -2.089045 1.371038
H -6.462138 -1.044100 -0.452192
H -0.823751 3.109648 1.700860


%chk=000228488-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228488

0 1
O 0.845083 -0.181335 0.245298
O -0.715158 2.210586 1.253451
O -0.898376 2.370440 -1.058981
N -0.499700 -0.727721 0.184227
C 3.194511 -0.770192 0.183653
C 1.803247 -1.317271 0.403999
C -2.828996 -0.109741 -0.023581
C 3.552528 -0.210362 -1.070055
C 4.159771 -0.819985 1.218473
C -1.393962 0.238246 0.070225
C -3.800680 0.894072 -0.289367
C -3.258789 -1.456365 0.156758
C 4.855875 0.286492 -1.283802
C 5.469067 -0.331130 1.003492
C 5.819359 0.223512 -0.248379
C -5.169436 0.559751 -0.369005
C -4.624830 -1.783052 0.074124
C -5.588197 -0.777407 -0.188333
C -0.979829 1.694266 -0.012333
H 1.684631 -1.742276 1.417408
H 1.529165 -2.084405 -0.344045
H 2.803846 -0.155471 -1.868683
H 3.887172 -1.239512 2.194577
H -3.489326 1.931926 -0.450801
H -2.510960 -2.227967 0.363427
H 5.122558 0.720469 -2.253878
H 6.209230 -0.378247 1.809943
H 6.832579 0.605545 -0.416385
H -5.907369 1.342239 -0.576518
H -4.943867 -2.821590 0.215771
H -6.651173 -1.035283 -0.249729
H -0.390272 3.149668 1.170646


