%chk=000118616.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000118616

0 1
O -3.190087 -1.547702 -0.000089
O -3.559556 0.654545 -0.000293
C -0.424944 -1.426460 0.000111
C 0.971411 -0.860931 0.000166
C 0.901941 0.563869 0.000106
C -0.521823 0.955934 0.000044
C -1.286916 -0.178117 0.000048
C 2.197141 -1.512044 0.000244
C 2.062608 1.330166 0.000116
C -0.979822 2.356293 0.000074
C 3.362968 -0.730540 0.000263
C -2.737259 -0.239917 -0.000071
C 3.298320 0.667538 0.000198
H -0.629787 -2.059747 -0.885611
H -0.629877 -2.059770 0.885774
H 2.257831 -2.597260 0.000269
H 2.014753 2.417064 0.000054
H -0.622641 2.901370 0.887095
H -2.086079 2.432435 -0.001505
H -0.619847 2.902457 -0.885111
H 4.335513 -1.223150 0.000326
H 4.218968 1.248869 0.000210
H -4.182816 -1.594404 -0.000218


%chk=000118616-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000118616

0 1
O -3.234842 -1.593287 0.000192
O -3.589113 0.704535 -0.000027
C -0.434024 -1.452371 -0.000137
C 0.969586 -0.880788 0.000055
C 0.887451 0.545920 0.000065
C -0.530961 0.948390 -0.000094
C -1.307976 -0.204913 -0.000262
C 2.219827 -1.521588 0.000199
C 2.058387 1.340191 0.000224
C -0.982483 2.382784 -0.000034
C 3.394142 -0.726015 0.000360
C -2.770373 -0.255577 -0.000570
C 3.313505 0.690641 0.000376
H -0.635239 -2.089271 -0.883003
H -0.635481 -2.089290 0.882661
H 2.294533 -2.615034 0.000188
H 1.998542 2.434343 0.000252
H -0.585695 2.910768 0.888832
H -2.079189 2.457501 -0.001413
H -0.583197 2.911693 -0.887213
H 4.377289 -1.210090 0.000475
H 4.235012 1.283472 0.000508
H -4.229700 -1.571517 0.000566


