%chk=000180125.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180125

0 1
O 0.323545 1.333625 -0.000146
O 7.774564 -0.818396 0.000312
O 1.179893 -0.807647 0.000124
N 2.541857 1.120772 -0.000422
C -3.671732 0.164434 0.000035
C -5.106167 -0.205378 0.000095
C -2.995153 0.336465 1.218889
C -2.995205 0.336270 -1.218876
C -1.001883 0.852963 -0.000078
C -1.642166 0.681159 1.230344
C -1.642219 0.680960 -1.230444
C -5.480654 -1.557275 0.000425
C -6.088957 0.795493 -0.000177
C 3.855112 0.539475 -0.000207
C -6.834557 -1.903273 0.000480
C -7.440969 0.441803 -0.000119
C 4.953183 1.430614 -0.000028
C 4.060289 -0.847987 -0.000222
C -7.815270 -0.905889 0.000208
C 6.440379 -0.469809 0.000096
C 6.246361 0.928918 0.000112
C 5.360576 -1.359177 -0.000064
C 1.360748 0.385530 -0.000095
C 8.101094 -2.228788 -0.000080
H -3.528810 0.196007 2.159346
H -3.528903 0.195660 -2.159287
H -1.096201 0.814657 2.161638
H -1.096295 0.814309 -2.161783
H -4.715696 -2.332552 0.000635
H -5.796356 1.844132 -0.000431
H -7.125537 -2.952571 0.000734
H -8.204153 1.218372 -0.000329
H 4.793923 2.508172 -0.000003
H 3.208267 -1.538458 -0.000342
H -8.868852 -1.178373 0.000252
H 2.474957 2.142301 -0.000598
H 7.112968 1.588245 0.000243
H 5.509581 -2.435262 -0.000058
H 7.720904 -2.707646 -0.906942
H 7.720954 -2.708095 0.906568
H 9.198879 -2.203261 -0.000106


%chk=000180125-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180125

0 1
O 0.348444 1.369494 0.000468
O 7.924847 -0.809616 -0.000541
O 1.181997 -0.857716 0.000689
N 2.581331 1.059104 0.000289
C -3.737639 0.190538 0.000145
C -5.188997 -0.197550 0.000026
C -3.038712 0.376625 1.221556
C -3.038548 0.376732 -1.221155
C -1.009035 0.918614 0.000361
C -1.674318 0.739902 1.228060
C -1.674151 0.740001 -1.227445
C -5.569943 -1.565003 0.000725
C -6.203172 0.795578 -0.000797
C 3.896003 0.508311 0.000091
C -6.935399 -1.930947 0.000593
C -7.568793 0.430037 -0.000923
C 4.988801 1.418170 -0.000232
C 4.152518 -0.883883 0.000200
C -7.939002 -0.934673 -0.000231
C 6.567333 -0.446875 -0.000326
C 6.310842 0.947430 -0.000440
C 5.483474 -1.357531 -0.000003
C 1.383526 0.376108 0.000683
C 8.237278 -2.240304 -0.000517
H -3.567495 0.234193 2.170118
H -3.567200 0.234367 -2.169801
H -1.130359 0.884226 2.166746
H -1.130062 0.884393 -2.166044
H -4.793263 -2.338201 0.001355
H -5.917614 1.853784 -0.001328
H -7.214490 -2.990745 0.001128
H -8.340544 1.208145 -0.001555
H 4.803268 2.499629 -0.000318
H 3.316686 -1.586851 0.000453
H -8.997423 -1.218675 -0.000332
H 2.496862 2.077935 0.000141
H 7.158320 1.639096 -0.000689
H 5.654032 -2.438086 0.000095
H 7.838350 -2.740057 -0.904995
H 7.838789 -2.739930 0.904225
H 9.335756 -2.295267 -0.000777


