%chk=000270593.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270593

0 1
O 1.223628 2.028923 -1.841353
O -3.644826 -3.041749 0.207792
N 0.920532 1.642249 0.395304
N -1.401463 -3.515390 -0.053516
C 0.318623 0.340090 0.233658
C -1.087338 0.216125 0.179989
C 1.134210 -0.809054 0.159726
C -0.861264 -2.194964 0.042613
C -1.672899 -1.050730 0.097930
C 0.542686 -2.072784 0.070180
C -1.963828 1.410863 0.197782
C 2.613407 -0.713449 0.169925
C -2.828526 1.634623 1.279449
C -1.940166 2.308557 -0.881137
C 3.286233 -0.172754 -0.936386
C 3.340040 -1.181052 1.275115
C 1.329476 2.423849 -0.693185
C -3.660644 2.757558 1.282263
C -2.778271 3.425688 -0.872730
C 4.681305 -0.105996 -0.935228
C 4.735656 -1.106349 1.270430
C -3.637123 3.652913 0.208158
C 5.407354 -0.571875 0.166244
C -2.772201 -3.863685 0.024086
C 1.905381 3.760819 -0.314966
C -3.026369 -5.336839 -0.136360
H -2.766770 -1.142121 0.066302
H 1.181815 -2.952002 0.012643
H 0.972458 1.985697 1.350079
H -2.854831 0.930866 2.109953
H -1.265445 2.127195 -1.723312
H 2.711844 0.202966 -1.790447
H 2.816820 -1.598131 2.133302
H -0.716564 -4.260889 -0.194194
H -4.332664 2.930988 2.120842
H -2.764189 4.118439 -1.712721
H 5.202880 0.310808 -1.795648
H 5.300235 -1.466744 2.128282
H -4.289942 4.523370 0.210800
H 6.494106 -0.518500 0.163644
H 1.176919 4.396989 0.204431
H 2.215765 4.302584 -1.223610
H 2.794196 3.667918 0.322527
H -2.704202 -5.715547 -1.115702
H -4.109576 -5.536514 -0.060020
H -2.537969 -5.938961 0.640763


%chk=000270593-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270593

0 1
O 1.283860 2.249038 -1.948252
O -3.719901 -3.090907 0.258413
N 0.947021 1.695289 0.292969
N -1.412388 -3.492436 0.079637
C 0.337045 0.393959 0.107964
C -1.085423 0.274165 0.112940
C 1.156431 -0.775129 0.087576
C -0.878067 -2.172622 0.098617
C -1.684456 -1.009973 0.115983
C 0.532339 -2.043244 0.082774
C -1.991382 1.466207 0.135999
C 2.652921 -0.725554 0.108509
C -3.027916 1.550422 1.104234
C -1.881220 2.495421 -0.837880
C 3.386713 -0.013543 -0.878073
C 3.367579 -1.455814 1.096753
C 1.368006 2.547543 -0.717362
C -3.920259 2.645287 1.113915
C -2.778408 3.585600 -0.830919
C 4.798856 -0.028565 -0.866591
C 4.780079 -1.465088 1.109840
C -3.797571 3.669392 0.146700
C 5.502066 -0.749902 0.126629
C -2.749533 -3.895829 0.148254
C 1.923363 3.886753 -0.242687
C -2.961529 -5.406788 0.071421
H -2.770740 -1.111422 0.110061
H 1.165876 -2.938558 0.046670
H 1.031946 2.026823 1.256803
H -3.127638 0.757335 1.854456
H -1.115823 2.421039 -1.617804
H 2.848087 0.528358 -1.662641
H 2.810993 -2.000298 1.869101
H -0.720169 -4.240578 0.001543
H -4.710206 2.695709 1.871724
H -2.688727 4.362974 -1.598194
H 5.349202 0.517345 -1.641185
H 5.314194 -2.025456 1.885631
H -4.492786 4.516536 0.149198
H 6.597902 -0.757872 0.132113
H 1.211571 4.686748 -0.514713
H 2.867975 4.090556 -0.773314
H 2.104775 3.931445 0.845147
H -3.544358 -5.640108 -0.836780
H -3.565496 -5.727058 0.937162
H -2.026309 -5.993203 0.051359


