%chk=000179370.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179370

0 1
O 2.862843 -0.527057 1.719105
C -0.274809 0.268235 0.169144
C -1.806431 -0.021000 0.380471
C -0.159142 1.753208 0.663925
C -2.497200 1.307037 -0.010554
C -1.476592 2.432411 0.225624
C 0.583270 -0.658738 1.048942
C 0.122437 0.110253 -1.316326
C -2.393324 -1.242318 -0.367663
C 1.069142 2.522582 0.193791
C 2.067275 -0.514371 0.802783
C 1.581480 -0.081387 -1.573526
C -1.931647 -2.564613 0.260579
C -3.928762 -1.208236 -0.383955
C 2.483493 -0.385752 -0.628241
C 3.931259 -0.601479 -0.912840
H -1.968507 -0.185369 1.473094
H -0.134837 1.729724 1.782548
H -3.412053 1.461825 0.583967
H -2.813077 1.291584 -1.067954
H -1.333770 3.029068 -0.690988
H -1.824174 3.140215 0.995284
H 0.304301 -1.723567 0.854045
H 0.367083 -0.495499 2.123773
H -0.249896 0.989044 -1.884288
H -0.421310 -0.763017 -1.753744
H -2.031039 -1.216411 -1.429944
H 1.996339 2.068929 0.566399
H 1.146870 2.566406 -0.897684
H 1.047585 3.555161 0.561789
H 1.878271 0.031106 -2.618491
H -2.311337 -2.683087 1.281368
H -2.284984 -3.423968 -0.319105
H -0.833442 -2.630812 0.307539
H -4.341199 -1.102368 0.625295
H -4.339421 -2.132076 -0.806871
H -4.314381 -0.380704 -0.987755
H 4.125695 -1.643938 -1.201748
H 4.546040 -0.399970 -0.017924
H 4.303549 0.043848 -1.717064


%chk=000179370-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179370

0 1
O 2.890815 -0.759699 1.787449
C -0.296224 0.263152 0.138782
C -1.847823 0.002376 0.326852
C -0.199102 1.769759 0.601199
C -2.540010 1.355644 -0.065575
C -1.435948 2.449577 -0.039699
C 0.560039 -0.640627 1.070129
C 0.150466 0.076343 -1.340862
C -2.527801 -1.204444 -0.392282
C 1.108652 2.542234 0.344183
C 2.070106 -0.589080 0.833051
C 1.639037 -0.102623 -1.546923
C -1.891004 -2.588886 -0.114221
C -4.029965 -1.263879 -0.003596
C 2.545881 -0.410518 -0.568948
C 4.030663 -0.557768 -0.819282
H -1.991658 -0.154976 1.419898
H -0.365391 1.746875 1.701205
H -3.363517 1.592816 0.631136
H -2.992974 1.275070 -1.072774
H -1.191247 2.790061 -1.065197
H -1.738095 3.348647 0.527352
H 0.272769 -1.702175 0.944820
H 0.374653 -0.391608 2.132000
H -0.197659 0.930694 -1.955993
H -0.352501 -0.811227 -1.779728
H -2.479954 -1.018472 -1.487758
H 1.968362 2.110084 0.885286
H 1.364382 2.568654 -0.731153
H 0.994207 3.589172 0.684439
H 2.001795 0.016601 -2.579787
H -1.845319 -2.793799 0.972807
H -2.503485 -3.385691 -0.576489
H -0.869833 -2.682781 -0.524174
H -4.141813 -1.430538 1.085773
H -4.535474 -2.098220 -0.524749
H -4.563967 -0.332650 -0.260269
H 4.387835 -1.552051 -0.494556
H 4.599962 0.178723 -0.223183
H 4.276741 -0.419870 -1.886364


