%chk=000197198.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197198

0 1
O 3.723423 -2.001500 0.714008
O -5.110914 -1.694765 -1.252952
N 1.265270 0.538680 0.397497
C -1.255753 1.272823 -0.911893
C -0.579946 2.147322 0.185254
C 0.166506 1.207453 1.167832
C -0.129434 0.509353 -1.662182
C -0.824212 0.257611 1.879452
C -2.188430 0.240293 -0.285612
C 0.749913 -0.320981 -0.716852
C -1.953345 -0.244386 1.022485
C -1.996524 2.176162 -1.911766
C -1.560124 3.053139 0.931785
C 2.179139 -0.233849 1.303606
C -3.255989 -0.276734 -1.025084
C -2.800078 -1.219764 1.569415
C 3.410253 -0.629411 0.576006
C -4.083248 -1.251103 -0.448580
C -3.877164 -1.737495 0.846886
C 4.362587 -0.005630 -0.196679
C 5.328429 -1.021799 -0.564307
C 4.908847 -2.194370 0.001428
C 4.412949 1.416686 -0.588338
H 0.183926 2.795947 -0.314471
H 0.668544 1.835464 1.950638
H 0.501176 1.238011 -2.207888
H -0.569306 -0.155289 -2.428719
H -1.256599 0.793856 2.751471
H -0.272447 -0.604426 2.307252
H 0.185208 -1.205160 -0.347836
H 1.629995 -0.710250 -1.277284
H -1.363321 3.004711 -2.246446
H -2.309207 1.625844 -2.806320
H -2.899078 2.609478 -1.464951
H -1.083212 3.543473 1.786830
H -1.945215 3.844260 0.278648
H -2.426004 2.494930 1.308916
H 1.700763 -1.140253 1.748335
H 2.464245 0.430380 2.156068
H -3.465251 0.053467 -2.040983
H -2.619070 -1.588064 2.579421
H -4.524633 -2.490699 1.279481
H -5.659853 -2.380866 -0.804462
H 6.197208 -0.850448 -1.167752
H 5.258218 -3.201154 0.033133
H 4.690372 1.536896 -1.644374
H 3.431549 1.903332 -0.449977
H 5.147235 1.971424 0.012763


%chk=000197198-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197198

0 1
O 3.795610 -2.034155 0.601387
O -5.283239 -1.666348 -1.231545
N 1.249139 0.455799 0.395268
C -1.269568 1.241638 -0.935007
C -0.578141 2.117185 0.164545
C 0.177094 1.180081 1.140939
C -0.135850 0.438882 -1.664676
C -0.837589 0.269821 1.899115
C -2.238473 0.238422 -0.276257
C 0.735230 -0.393639 -0.708192
C -1.991650 -0.248415 1.043605
C -1.969140 2.144823 -1.982124
C -1.541971 3.067538 0.908143
C 2.208344 -0.255281 1.279548
C -3.347456 -0.264706 -0.997003
C -2.867199 -1.216833 1.591595
C 3.466926 -0.653083 0.560908
C -4.205590 -1.230042 -0.432910
C -3.971697 -1.718122 0.873527
C 4.432993 0.034834 -0.163300
C 5.409952 -0.953396 -0.592423
C 4.996107 -2.182723 -0.113495
C 4.459872 1.517022 -0.439477
H 0.195681 2.726197 -0.346788
H 0.699059 1.806078 1.893116
H 0.508303 1.165495 -2.198582
H -0.589626 -0.230448 -2.420998
H -1.256122 0.848752 2.748207
H -0.301274 -0.582889 2.361500
H 0.156466 -1.267630 -0.322640
H 1.603457 -0.801145 -1.257896
H -1.284061 2.954494 -2.296799
H -2.241255 1.577133 -2.890933
H -2.889726 2.606293 -1.584063
H -1.016757 3.588925 1.731171
H -1.940188 3.841570 0.228825
H -2.403255 2.526402 1.339609
H 1.784973 -1.184179 1.736169
H 2.448793 0.431844 2.115722
H -3.569937 0.084549 -2.008666
H -2.678968 -1.588752 2.606747
H -4.633143 -2.471137 1.321515
H -5.822871 -2.341043 -0.749923
H 6.304062 -0.759490 -1.183616
H 5.388414 -3.193974 -0.173471
H 4.669231 1.720824 -1.505960
H 3.485543 1.970204 -0.191831
H 5.246898 2.025228 0.150315


