%chk=000229372.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229372

0 1
O -2.537962 -0.400924 -1.367612
O -1.415983 0.886933 1.423072
O 0.215071 -2.342341 -0.053489
N -3.924742 4.192863 -1.782921
N 0.874283 2.469620 -1.378697
C -1.322519 -0.508679 -0.589993
C -1.679567 -0.429690 0.902682
C -0.788753 -1.895814 -0.993272
C -2.803587 0.897024 -1.927972
C -0.032029 1.175776 1.730772
C 1.473463 -1.769326 -0.087267
C -3.335566 1.839897 -0.837960
C 0.251899 2.569141 1.150386
C 1.906550 -0.808151 -1.005645
C 2.309414 -2.253845 0.938787
C 3.213687 -0.320657 -0.887454
C 3.605202 -1.753584 1.028176
C 4.059493 -0.783346 0.122508
C -3.662563 3.146041 -1.368787
C 0.603228 2.519465 -0.255989
H -0.610161 0.298508 -0.867305
H -1.150071 -1.194664 1.499625
H -2.773228 -0.524808 1.058930
H -0.399025 -1.910427 -2.024053
H -1.561798 -2.683035 -0.881739
H -1.900958 1.299582 -2.421642
H -3.576328 0.657305 -2.685209
H 0.020523 1.189850 2.836071
H 0.650520 0.402453 1.336676
H -2.580175 1.932726 -0.009676
H -4.227677 1.381456 -0.347813
H 1.064680 3.066838 1.730769
H -0.655153 3.211980 1.290792
H 1.268659 -0.445564 -1.806991
H 1.937324 -3.010442 1.624817
H 3.566316 0.430978 -1.596322
H 4.272342 -2.119704 1.809056
H 5.073289 -0.399032 0.203888


%chk=000229372-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229372

0 1
O -2.344004 -0.337512 -1.479501
O -1.606999 1.061955 1.405351
O 0.286261 -2.378179 0.162761
N -4.158397 4.187124 -2.109157
N 0.308526 3.107560 -1.066096
C -1.251368 -0.519414 -0.507826
C -1.716089 -0.341016 0.954179
C -0.768308 -1.964879 -0.775325
C -2.560326 1.021299 -1.994026
C -0.288181 1.419797 1.944455
C 1.608012 -1.930571 -0.050685
C -3.523154 1.818563 -1.068365
C -0.006961 2.892666 1.570720
C 2.024834 -1.115546 -1.132489
C 2.544954 -2.372725 0.916438
C 3.387633 -0.747396 -1.232483
C 3.898019 -1.996434 0.801970
C 4.328766 -1.179822 -0.272764
C -3.877984 3.127641 -1.635871
C 0.173824 3.049546 0.117923
H -0.437756 0.204734 -0.720570
H -1.132764 -1.005443 1.621459
H -2.786213 -0.597914 1.030954
H -0.438058 -2.066073 -1.824949
H -1.593694 -2.673473 -0.596202
H -1.601134 1.562120 -2.107417
H -3.018665 0.882403 -2.987443
H -0.300008 1.319916 3.048198
H 0.505334 0.762766 1.536476
H -3.049611 1.957898 -0.078248
H -4.447137 1.227648 -0.922332
H 0.900760 3.245109 2.095936
H -0.853218 3.521105 1.903618
H 1.321129 -0.768605 -1.894994
H 2.194912 -3.011727 1.733261
H 3.706325 -0.115050 -2.068451
H 4.618261 -2.344809 1.550571
H 5.380575 -0.888860 -0.359878


