%chk=000218305.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218305

0 1
O 4.537302 -1.045188 -1.255308
O 2.900559 -2.310051 -0.405087
C -0.469573 0.386108 0.080522
C 1.953039 0.580831 0.289017
C -0.564976 1.792831 -0.042472
C -1.683633 -0.419774 0.030058
C 3.320591 -0.033608 0.498448
C 0.810351 -0.200654 0.251597
C -2.934538 0.222432 -0.129026
C 1.852653 1.989334 0.158298
C 0.615983 2.580567 -0.002420
C -1.861849 2.413596 -0.207013
C -2.992221 1.664431 -0.246057
C -1.650310 -1.836332 0.133431
C 3.521142 -0.445039 1.958759
C -4.123182 -0.554130 -0.175342
C 3.494608 -1.259120 -0.382012
C -2.815720 -2.575893 0.085238
C -4.064378 -1.929728 -0.069190
H 4.115881 0.711776 0.216103
H 0.888457 -1.290266 0.346498
H 2.754025 2.599529 0.186157
H 0.533679 3.662617 -0.101735
H -1.898856 3.498750 -0.297457
H -3.972081 2.125459 -0.368031
H 3.345034 0.406206 2.629865
H 2.821685 -1.239372 2.256562
H 4.538831 -0.808865 2.142969
H -0.686599 -2.338146 0.248198
H -5.080802 -0.050167 -0.296497
H -2.783794 -3.661582 0.164180
H -4.973307 -2.528069 -0.104431
H 4.698301 -1.814481 -1.864323


%chk=000218305-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218305

0 1
O 4.430702 -0.797749 -1.468979
O 3.164735 -2.354097 -0.305346
C -0.454740 0.370392 0.084011
C 2.000528 0.587989 0.307840
C -0.550904 1.800718 -0.081264
C -1.680141 -0.435959 0.045481
C 3.378140 -0.041681 0.575120
C 0.837747 -0.201014 0.279878
C -2.949573 0.223827 -0.145976
C 1.893170 1.999269 0.130793
C 0.638967 2.589682 -0.055608
C -1.843467 2.419807 -0.273211
C -2.996975 1.661451 -0.302187
C -1.677308 -1.858077 0.187817
C 3.497827 -0.549773 2.036920
C -4.151521 -0.548775 -0.182776
C 3.619698 -1.191490 -0.397643
C -2.867723 -2.597431 0.147698
C -4.117836 -1.940494 -0.037714
H 4.152603 0.719943 0.381420
H 0.944122 -1.283510 0.403062
H 2.798872 2.616740 0.142552
H 0.555666 3.674945 -0.187838
H -1.887516 3.508512 -0.395278
H -3.974037 2.137485 -0.447263
H 3.289624 0.276200 2.738246
H 2.773927 -1.360650 2.223500
H 4.511639 -0.938744 2.240924
H -0.733046 -2.392855 0.327239
H -5.106780 -0.030314 -0.328781
H -2.835679 -3.686820 0.258052
H -5.044516 -2.523798 -0.067911
H 4.530099 -1.559725 -2.103280


