%chk=000203203.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203203

0 1
O 0.462299 -0.398684 0.946638
O -5.251932 1.181616 -1.882090
O -6.193761 -1.364349 1.259362
O -7.079604 -0.038491 -0.336169
N 4.296727 0.819427 -0.432453
N -0.585289 0.780367 -0.739666
C 5.484684 -0.084564 -0.357749
C 6.604698 0.548912 -1.212764
C 5.980269 -0.329857 1.087301
C 7.852133 -0.343070 -1.211235
C 7.231668 -1.216883 1.084864
C 8.344821 -0.612934 0.217299
C 3.059167 0.239724 0.162175
C 1.856191 0.890204 -0.551176
C 0.558950 0.337696 -0.009522
C -1.940486 0.446710 -0.472170
C -2.916518 0.994835 -1.327348
C -2.319335 -0.392968 0.597208
C -4.264791 0.687402 -1.088427
C -4.669695 -0.147725 -0.022531
C -3.660015 -0.677960 0.807742
C -6.085587 -0.449752 0.213420
C -7.541188 -1.759847 1.621587
H 5.193892 -1.066443 -0.813912
H 6.859857 1.554936 -0.831202
H 6.240651 0.699717 -2.247243
H 5.185597 -0.805365 1.689979
H 6.206338 0.632740 1.581892
H 7.630471 -1.301464 -1.719312
H 8.654613 0.136162 -1.802894
H 7.594463 -1.355553 2.120730
H 6.974419 -2.228030 0.714143
H 8.704769 0.329359 0.672993
H 9.215844 -1.293843 0.193867
H 4.503471 1.725144 -0.000240
H 3.030311 -0.861752 0.002514
H 2.975233 0.395935 1.260074
H 1.891017 1.992836 -0.426651
H 1.954829 0.716455 -1.645657
H -0.431797 1.396589 -1.543495
H -2.645586 1.639429 -2.154162
H -1.557545 -0.819689 1.259134
H -3.956342 -1.331199 1.638561
H -4.905649 1.760983 -2.610942
H -8.040437 -2.206032 0.755361
H -7.370325 -2.489856 2.418685
H -8.095799 -0.885368 1.976081


%chk=000203203-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203203

0 1
O 0.468592 -1.422256 -0.316233
O -5.120100 2.313573 -0.380106
O -6.316772 -1.583473 0.976756
O -7.069883 0.570805 0.516186
N 4.310606 0.421796 -0.942636
N -0.569877 0.641145 -0.749551
C 5.554507 -0.227525 -0.450727
C 6.745296 0.218619 -1.330160
C 5.868374 0.030503 1.052540
C 8.068909 -0.454296 -0.893526
C 7.187777 -0.651505 1.490875
C 8.371665 -0.201392 0.602988
C 3.045933 -0.034548 -0.331083
C 1.844523 0.406392 -1.196730
C 0.535645 -0.221538 -0.707497
C -1.923098 0.372873 -0.414138
C -2.849942 1.436692 -0.551864
C -2.376552 -0.894017 0.045738
C -4.217065 1.258330 -0.240192
C -4.691819 -0.007840 0.222223
C -3.737078 -1.054478 0.349440
C -6.119389 -0.244349 0.562697
C -7.708820 -1.920663 1.338949
H 5.416244 -1.321336 -0.588605
H 6.854623 1.322662 -1.252343
H 6.515571 -0.009908 -2.387446
H 5.029646 -0.324168 1.682883
H 5.952548 1.128114 1.208889
H 7.994814 -1.547735 -1.068573
H 8.903169 -0.087580 -1.522424
H 7.396037 -0.428803 2.555451
H 7.072531 -1.752807 1.413002
H 8.555321 0.881852 0.761182
H 9.297687 -0.730688 0.900477
H 4.401734 1.448866 -0.921566
H 3.053404 -1.138792 -0.295543
H 2.888541 0.316905 0.716881
H 1.777297 1.512882 -1.230651
H 2.037404 0.062295 -2.231369
H -0.374424 1.590730 -1.075145
H -2.505929 2.419059 -0.906833
H -1.667286 -1.714223 0.155349
H -4.098424 -2.023107 0.702471
H -4.657451 3.125656 -0.710608
H -8.382840 -1.752630 0.481637
H -7.677376 -2.984352 1.615585
H -8.048571 -1.300240 2.185947


