%chk=000189577.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189577

0 1
O 0.308118 -1.864265 0.502981
O 3.963753 -0.673438 -0.745274
N 4.991135 0.988477 0.568733
C -5.339611 1.270428 0.137178
C -5.103052 -0.264383 0.015675
C -4.619940 2.016504 -0.999693
C -4.834001 1.786382 1.495398
C -6.858034 1.527039 0.030504
C -3.661333 -0.675419 0.103418
C -3.087669 -0.989951 1.352096
C -2.875481 -0.768972 -1.051819
C -1.758199 -1.381378 1.447483
C -1.533221 -1.161196 -0.984848
C -0.989271 -1.462032 0.267721
C 1.212049 -1.978166 -0.639650
C 2.536984 -2.371717 0.006954
C 3.335146 -1.171333 0.496053
C 4.773679 0.414118 -0.649429
C 5.344150 0.870821 -1.862974
C 6.176976 1.979855 -1.789368
C 5.813925 2.074708 0.597821
C 6.420832 2.596282 -0.550063
H -5.689176 -0.779895 0.803019
H -5.537431 -0.618397 -0.940916
H -4.813339 3.092801 -0.955338
H -3.533979 1.879076 -0.939175
H -4.943255 1.664071 -1.983077
H -3.751312 1.645706 1.595533
H -5.034256 2.855569 1.615747
H -5.312704 1.265948 2.329628
H -7.410734 1.019708 0.826768
H -7.260604 1.180751 -0.925949
H -7.084001 2.595436 0.109456
H -3.694170 -0.924288 2.255332
H -3.309192 -0.533012 -2.023331
H -1.299869 -1.625695 2.402287
H -0.945905 -1.223940 -1.893459
H 0.822383 -2.761019 -1.311854
H 1.261966 -1.006219 -1.160683
H 3.145193 -2.955314 -0.717242
H 2.335900 -3.050757 0.866462
H 4.138473 -1.439970 1.202340
H 2.711716 -0.363847 0.918439
H 5.125069 0.360228 -2.794907
H 6.643077 2.374545 -2.693192
H 5.973051 2.519992 1.587280
H 7.069965 3.463757 -0.485367


%chk=000189577-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189577

0 1
O 0.513046 -1.981294 0.512469
O 3.713925 -0.679992 -0.849273
N 4.902101 0.719892 0.647907
C -5.173359 1.408829 0.031321
C -4.961394 -0.142943 0.193634
C -4.556951 1.907120 -1.300927
C -4.531689 2.177302 1.214893
C -6.703246 1.671486 0.018020
C -3.520915 -0.630596 0.246449
C -2.820674 -0.730670 1.481054
C -2.826490 -1.012704 -0.927923
C -1.487298 -1.176674 1.540689
C -1.486395 -1.462947 -0.893279
C -0.812188 -1.542067 0.349868
C 1.260031 -2.374448 -0.697651
C 2.666591 -2.766381 -0.238537
C 3.476048 -1.589543 0.307291
C 4.435058 0.479828 -0.602957
C 4.642975 1.352628 -1.706224
C 5.374533 2.531010 -1.477840
C 5.610470 1.872742 0.846189
C 5.872981 2.805690 -0.176278
H -5.488048 -0.452288 1.119221
H -5.486770 -0.635622 -0.649472
H -4.731664 2.992738 -1.425283
H -3.466828 1.730783 -1.328144
H -5.010560 1.389620 -2.168387
H -3.437288 2.030057 1.242159
H -4.728133 3.262344 1.123103
H -4.947502 1.838512 2.183460
H -7.173721 1.335570 0.961962
H -7.193140 1.133668 -0.816308
H -6.916216 2.750412 -0.102228
H -3.333740 -0.459577 2.411689
H -3.343163 -0.964819 -1.894438
H -0.953654 -1.255130 2.493047
H -0.990344 -1.750140 -1.825034
H 0.751318 -3.231574 -1.184447
H 1.303727 -1.524408 -1.406686
H 3.207256 -3.218360 -1.091649
H 2.584827 -3.535377 0.552688
H 4.450928 -1.910256 0.715510
H 2.929016 -1.040274 1.092489
H 4.237177 1.094616 -2.687645
H 5.555868 3.230221 -2.301057
H 5.972291 2.037260 1.867536
H 6.445007 3.713354 0.035715


