%chk=000181331.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181331

0 1
O 1.688618 1.349502 -1.389781
O -1.684895 -1.345449 1.403617
C 0.674884 0.056636 0.373616
C -0.679389 -0.048654 -0.361234
C 1.503306 -1.258833 0.290760
C -1.508125 1.266597 -0.278185
C 1.478391 1.222439 -0.203574
C -1.482879 -1.214185 0.216433
C 2.795725 -1.124745 1.106040
C 1.816441 -1.674145 -1.148283
C -2.800932 1.132021 -1.092659
C -1.820699 1.681907 1.161024
C 1.988795 2.225120 0.793796
C -2.004042 -2.210958 -0.781191
H 0.458723 0.239917 1.458921
H -0.463584 -0.232567 -1.446417
H 0.883475 -2.064141 0.765234
H -0.889058 2.072357 -0.753018
H 2.598791 -0.795486 2.131624
H 3.498531 -0.418662 0.649745
H 3.315089 -2.088529 1.173523
H 2.278130 -0.851728 -1.716957
H 2.510740 -2.520226 -1.178783
H 0.915165 -1.966771 -1.695217
H -3.501706 0.422873 -0.638045
H -3.322579 2.094809 -1.156812
H -2.604075 0.806290 -2.119390
H -0.918548 1.970801 1.708717
H -2.285490 0.860869 1.728936
H -2.511819 2.530596 1.191584
H 2.560460 1.752220 1.601943
H 2.645439 2.964862 0.312145
H 1.163185 2.780462 1.259123
H -1.185338 -2.797953 -1.219483
H -2.541687 -1.731894 -1.608533
H -2.693242 -2.924652 -0.305719


%chk=000181331-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181331

0 1
O 1.603158 1.444054 -1.436304
O -1.599647 -1.445825 1.443622
C 0.685355 0.077008 0.370889
C -0.689586 -0.066567 -0.358054
C 1.558518 -1.239155 0.290580
C -1.565121 1.247955 -0.272176
C 1.471575 1.273671 -0.190956
C -1.474099 -1.266413 0.198937
C 2.855018 -1.116836 1.129579
C 1.893906 -1.691539 -1.150245
C -2.858990 1.129492 -1.115718
C -1.905350 1.690612 1.170557
C 2.089082 2.245625 0.805052
C -2.098509 -2.230004 -0.800948
H 0.490851 0.245310 1.447066
H -0.495044 -0.230372 -1.434956
H 0.938589 -2.024180 0.769650
H -0.944943 2.036968 -0.744410
H 2.642631 -0.767471 2.157690
H 3.577658 -0.419313 0.665460
H 3.352632 -2.100772 1.206945
H 2.467549 -0.918917 -1.691072
H 2.500038 -2.616222 -1.119428
H 0.989040 -1.907404 -1.746203
H -3.581961 0.427708 -0.658633
H -3.357803 2.113238 -1.187680
H -2.643061 0.787592 -2.145585
H -1.002602 1.901148 1.771566
H -2.481948 0.914956 1.703883
H -2.510441 2.616109 1.143978
H 2.673640 1.707406 1.572903
H 2.729435 2.975623 0.285095
H 1.283914 2.786090 1.340958
H -1.296225 -2.780078 -1.331633
H -2.672145 -1.685505 -1.572348
H -2.749316 -2.953292 -0.284563


