%chk=000186369.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186369

0 1
O -2.879178 2.789011 0.549732
O -3.619528 1.071094 1.772593
C -2.830592 0.709125 -0.566106
C -1.626866 -0.174949 -0.325766
C -4.072162 -0.070040 -1.034741
C -1.786160 -1.559547 -0.136515
C -3.127193 -2.242649 -0.199542
C -4.317084 -1.281797 -0.134148
C -0.332644 0.397920 -0.296036
C 0.798247 -0.435510 -0.077921
C 0.624342 -1.834392 0.117513
C -0.664449 -2.374649 0.084747
C 2.130116 0.125605 -0.052371
C -0.097897 1.821809 -0.481359
C 2.319340 1.520677 -0.246177
C -3.163369 1.445400 0.722207
C 3.258373 -0.714489 0.166468
C 1.795489 -2.667399 0.343370
C 1.148852 2.351211 -0.460170
C 3.041209 -2.138070 0.366005
C 3.619041 2.054161 -0.222476
C 4.543872 -0.152756 0.185141
C 4.717535 1.220591 -0.008792
H -2.575302 1.469845 -1.356747
H -3.916012 -0.397101 -2.082544
H -4.959522 0.590894 -1.049446
H -3.172888 -2.833724 -1.140358
H -3.211528 -2.982800 0.624412
H -5.246793 -1.802446 -0.427467
H -4.470668 -0.943917 0.915616
H -0.799787 -3.445227 0.234149
H -0.967203 2.469867 -0.630404
H 1.630059 -3.733954 0.494235
H 1.308643 3.420595 -0.600513
H 3.919135 -2.761605 0.535133
H 3.768501 3.122379 -0.370898
H 5.411613 -0.788998 0.351935
H 5.721403 1.643778 0.007951
H -3.058145 3.331557 1.361287


%chk=000186369-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186369

0 1
O -3.283590 2.916618 0.375746
O -3.364534 1.125039 1.845862
C -2.839957 0.727522 -0.562661
C -1.625927 -0.180973 -0.327032
C -4.115980 -0.063471 -0.984433
C -1.789979 -1.581627 -0.148127
C -3.155880 -2.261245 -0.219678
C -4.342045 -1.288737 -0.078657
C -0.312323 0.396959 -0.288977
C 0.838934 -0.447552 -0.077829
C 0.657231 -1.865988 0.106459
C -0.653488 -2.395235 0.068595
C 2.164894 0.108431 -0.046915
C -0.079396 1.819733 -0.457594
C 2.360813 1.524961 -0.227839
C -3.168164 1.547330 0.686652
C 3.308492 -0.747366 0.164854
C 1.818744 -2.703392 0.323080
C 1.196578 2.355122 -0.431505
C 3.092286 -2.167177 0.349557
C 3.678689 2.057838 -0.199409
C 4.608602 -0.174906 0.186960
C 4.789689 1.213643 0.005515
H -2.611486 1.452327 -1.363249
H -3.979076 -0.394688 -2.032677
H -4.990947 0.613129 -0.969953
H -3.232527 -2.787417 -1.194859
H -3.211204 -3.047503 0.556964
H -5.283027 -1.799404 -0.355785
H -4.438501 -0.958954 0.971863
H -0.793321 -3.474826 0.210258
H -0.928931 2.493179 -0.604020
H 1.665461 -3.779730 0.464838
H 1.341677 3.433882 -0.564804
H 3.964471 -2.811297 0.512330
H 3.823434 3.135688 -0.337477
H 5.476068 -0.825772 0.347938
H 5.799622 1.637325 0.025699
H -3.524603 3.418035 1.202305


