%chk=000268855.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268855

0 1
O 2.403559 -0.133726 1.513143
O 1.884500 2.914675 0.086561
O 3.734155 0.864817 -1.683908
O 4.303622 -1.703713 -1.148540
O -4.234839 -0.709824 -0.580119
N 0.174197 0.112249 0.780090
N -1.201434 2.033842 -0.095047
N -3.449417 1.449601 -0.740104
N -2.537580 -3.832481 0.679564
C 1.436628 0.826192 1.075568
C 2.000714 1.521668 -0.196609
C 3.464393 1.014991 -0.301250
C 3.461070 -0.297124 0.525282
C 3.151036 -1.559542 -0.291282
C -0.989488 0.697679 0.258590
C -0.090713 -1.263720 0.990735
C -1.980926 -0.297001 0.123589
C -1.399088 -1.523956 0.590463
C -3.308510 0.037538 -0.405809
C -2.511254 2.330396 -0.596171
C -2.035129 -2.791787 0.637564
H 1.295274 1.524871 1.942041
H 1.445948 1.297665 -1.138520
H 4.191479 1.757922 0.097968
H 4.376565 -0.428653 1.144437
H 2.239213 -1.454043 -0.907506
H 3.063711 -2.447881 0.361430
H 0.650473 -1.916333 1.420896
H 2.395659 3.441581 -0.574536
H 4.257324 0.027478 -1.870590
H -0.471437 2.737649 0.020367
H 4.187699 -2.479509 -1.740228
H -2.664301 3.389682 -0.860567


%chk=000268855-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268855

0 1
O 2.328369 -0.450931 1.391847
O 1.591683 2.711909 -0.229940
O 4.202979 1.316055 -1.302221
O 4.622943 -1.308255 -1.421729
O -4.506931 -0.470004 -0.333887
N 0.057260 -0.024479 0.748988
N -1.125209 1.939528 -0.234657
N -3.469617 1.614586 -0.743607
N -3.013015 -3.712279 1.202534
C 1.371758 0.598515 1.007545
C 1.972588 1.298132 -0.232698
C 3.492324 1.063278 -0.066351
C 3.529939 -0.380847 0.505671
C 3.436950 -1.494751 -0.557810
C -1.054533 0.636004 0.229757
C -0.338326 -1.322543 1.114627
C -2.164352 -0.228172 0.232449
C -1.696667 -1.481134 0.798661
C -3.464260 0.235500 -0.281682
C -2.379465 2.351523 -0.704645
C -2.433549 -2.683754 1.010673
H 1.281097 1.317133 1.845288
H 1.627847 0.814384 -1.168492
H 3.873172 1.766656 0.700136
H 4.406194 -0.555027 1.149336
H 2.503340 -1.410023 -1.149015
H 3.459983 -2.480997 -0.059148
H 0.367093 -2.011116 1.568196
H 2.156084 3.195615 -0.885645
H 4.549651 0.442106 -1.658550
H -0.285542 2.546392 -0.272105
H 4.759098 -2.079287 -2.022973
H -2.415782 3.387485 -1.063050


