%chk=000279645.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279645

0 1
O -4.127608 1.941313 0.202577
O -5.566678 -0.614269 0.308434
O 6.473513 0.514685 0.590842
N 0.948355 -1.800250 -2.354562
C -1.409933 -0.478734 -0.167212
C 0.065102 -0.462075 -0.319633
C -2.105868 0.729262 -0.012357
C 2.325628 0.274902 0.490773
C -3.497149 0.706968 0.134719
C -2.102674 -1.700870 -0.164518
C -4.194881 -0.521965 0.109072
C 0.864911 0.186622 0.551883
C -3.491608 -1.724541 -0.031042
C 3.064055 0.138972 1.688556
C 3.005656 0.513373 -0.712971
C 5.107903 0.454505 0.453499
C 4.447845 0.220361 1.681250
C 4.399274 0.608452 -0.744141
C 0.562825 -1.199516 -1.444285
C -4.915826 2.145906 1.408455
C -6.354663 -0.007392 -0.754508
C 7.267951 0.724354 -0.602903
H -1.587799 1.687950 -0.015787
H -1.555032 -2.637641 -0.274700
H 0.412659 0.697495 1.413469
H -4.042585 -2.665304 -0.036078
H 2.540108 -0.042534 2.628164
H 2.445277 0.636810 -1.642072
H 5.035111 0.107899 2.590244
H 4.905754 0.792086 -1.686224
H -4.240385 2.244700 2.262399
H -5.627176 1.325122 1.556767
H -5.426486 3.090344 1.191961
H -6.232919 -0.591992 -1.670526
H -6.060632 1.037176 -0.906684
H -7.373674 -0.089413 -0.361897
H 7.034188 1.695132 -1.048859
H 7.118208 -0.098168 -1.308472
H 8.288052 0.712875 -0.196433


%chk=000279645-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279645

0 1
O -4.103073 1.371790 1.425279
O -5.724947 -0.371412 -0.295221
O 6.474146 1.363554 0.322968
N 0.973614 -2.837979 -1.534291
C -1.457406 -0.556481 -0.376495
C 0.031792 -0.623153 -0.455903
C -2.118257 0.359241 0.488158
C 2.309752 0.543554 0.022318
C -3.521375 0.433307 0.539175
C -2.261740 -1.430668 -1.161298
C -4.314229 -0.402416 -0.303766
C 0.855769 0.406164 -0.023647
C -3.667121 -1.347117 -1.127703
C 2.829894 1.791629 0.498562
C 3.256904 -0.453992 -0.358950
C 5.124229 1.026926 0.199559
C 4.205184 2.036823 0.587631
C 4.641732 -0.221941 -0.273360
C 0.567841 -1.824982 -1.039080
C -4.915176 0.768427 2.509619
C -6.327691 0.925631 -0.688637
C 7.469845 0.357014 -0.064822
H -1.564893 1.006077 1.176106
H -1.784332 -2.164775 -1.818696
H 0.326292 1.295738 0.344495
H -4.286987 -2.000769 -1.749217
H 2.128657 2.579022 0.801300
H 2.917960 -1.424596 -0.727358
H 4.595623 2.991815 0.951013
H 5.332081 -1.014942 -0.575306
H -4.272707 0.147763 3.162339
H -5.734211 0.152403 2.096493
H -5.319761 1.618486 3.079552
H -6.089214 1.144962 -1.746313
H -5.963082 1.745253 -0.044337
H -7.413137 0.789871 -0.568964
H 7.372424 0.090082 -1.134412
H 7.380894 -0.553501 0.557907
H 8.443506 0.835789 0.112501


