%chk=000285009.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285009

0 1
O -1.631639 2.180769 1.448878
O -0.190791 -2.628322 1.190112
O -4.258704 3.384869 -0.475780
O -0.398198 -1.279516 -0.611209
N 0.076328 1.637858 0.074962
N 3.165398 0.006219 1.076531
C 0.800874 0.881985 1.151159
C 0.701979 1.420999 -1.270822
C 2.116160 0.525742 0.474875
C 2.051761 0.849722 -0.942002
C 0.030589 -0.356387 1.633548
C -1.183832 2.195843 0.308090
C 3.132950 0.604189 -1.732432
C 4.304400 0.033878 -1.121828
C 4.287611 -0.249971 0.274699
C -1.887300 2.828946 -0.868243
C -0.208895 -1.396322 0.577748
C -2.912674 3.881759 -0.428032
C 5.484159 -0.257306 -1.867548
C 5.441531 -0.815224 0.901494
C 6.582899 -0.801319 -1.244460
C 6.561085 -1.082109 0.151102
C -0.431794 -3.813819 0.367465
C -4.591627 2.396519 0.527240
C -4.626593 1.020777 -0.085123
C -1.914224 -3.959752 0.095849
C -4.893791 0.856529 -1.451491
C -4.424707 -0.104514 0.727026
C -4.957402 -0.425564 -2.002153
C -4.499574 -1.385347 0.173082
C -4.763461 -1.548610 -1.190728
H 0.958183 1.571176 2.025779
H 0.099214 0.689113 -1.866128
H 0.764789 2.380261 -1.824030
H -0.960011 -0.026984 2.043350
H 0.570946 -0.809589 2.499036
H 3.138886 0.819989 -2.799061
H -1.174250 3.278338 -1.585250
H -2.420610 2.026357 -1.435654
H -2.695213 4.267148 0.586310
H -2.969311 4.718282 -1.150756
H 5.497074 -0.041658 -2.935287
H 5.401150 -1.022185 1.972580
H 7.487319 -1.026071 -1.809090
H 7.449236 -1.512974 0.613358
H -0.026408 -4.606087 1.023110
H 0.163797 -3.724859 -0.558456
H -3.889007 2.456447 1.383911
H -5.605225 2.710196 0.848626
H -2.496468 -3.953428 1.025791
H -2.285363 -3.130209 -0.527583
H -2.135269 -4.893916 -0.432910
H -5.050244 1.740511 -2.071978
H -4.208082 0.017560 1.786901
H -5.162621 -0.550616 -3.063626
H -4.352846 -2.257367 0.807574
H -4.819283 -2.546155 -1.620030


%chk=000285009-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285009

0 1
O -1.611986 2.338923 1.428032
O -0.381785 -2.776298 1.174561
O -4.259858 3.484333 -0.599113
O -0.022498 -1.457103 -0.713790
N -0.014760 1.565473 -0.046646
N 3.048610 -0.054558 1.045342
C 0.686320 0.822178 1.039816
C 0.682652 1.480009 -1.361629
C 2.029239 0.518623 0.397915
C 2.028926 0.901994 -0.985325
C -0.064693 -0.437011 1.547376
C -1.142403 2.306508 0.239592
C 3.170878 0.684146 -1.743295
C 4.308781 0.080207 -1.104963
C 4.205788 -0.279330 0.299295
C -1.765606 3.093457 -0.921638
C -0.151865 -1.560764 0.530100
C -2.907388 4.044340 -0.494980
C 5.533039 -0.184266 -1.798684
C 5.324771 -0.886142 0.949841
C 6.611489 -0.778842 -1.138104
C 6.506508 -1.131973 0.244828
C -0.464609 -3.994780 0.308278
C -4.644138 2.536014 0.467533
C -4.626716 1.088109 -0.004796
C -1.897542 -4.226687 -0.176116
C -5.016658 0.756254 -1.327257
C -4.277919 0.047080 0.890974
C -5.067615 -0.593458 -1.741811
C -4.332882 -1.304338 0.479494
C -4.730873 -1.628944 -0.838053
H 0.790965 1.492888 1.913764
H 0.139709 0.803746 -2.049703
H 0.768568 2.476853 -1.833974
H -1.084613 -0.132916 1.848631
H 0.444004 -0.818203 2.449492
H 3.222609 0.948325 -2.806176
H -0.970712 3.692397 -1.412133
H -2.145583 2.393141 -1.691260
H -2.720510 4.408779 0.534965
H -2.936738 4.905054 -1.185457
H 5.612842 0.086052 -2.858790
H 5.216981 -1.145314 2.007545
H 7.544028 -0.978146 -1.677210
H 7.359985 -1.597568 0.749640
H -0.113287 -4.803464 0.968964
H 0.229950 -3.865113 -0.540274
H -3.988541 2.661903 1.349018
H -5.678091 2.824787 0.740025
H -2.592654 -4.312492 0.677364
H -2.229451 -3.399854 -0.825140
H -1.944823 -5.167745 -0.755468
H -5.270074 1.565507 -2.020719
H -3.956869 0.298719 1.909440
H -5.372859 -0.838772 -2.765803
H -4.059219 -2.099380 1.182908
H -4.777919 -2.676538 -1.157931


