%chk=000185542.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185542

0 1
O -4.516232 -1.310509 -0.059883
O 0.120310 -2.631108 -0.454258
C -2.526059 -0.286939 0.818035
C -1.811913 1.040343 0.456501
C -3.994701 -0.045721 0.380866
C -2.548565 1.579082 -0.796111
C -1.904357 -1.469187 0.077948
C -3.965302 0.981438 -0.770779
C -0.324617 0.913909 0.237456
C -0.409508 -1.595268 0.392451
C 0.350498 -0.290791 0.231130
C 0.390674 2.142667 0.059594
C 1.787223 -0.307171 0.114819
C 2.482696 0.918143 -0.063240
C 1.748948 2.146140 -0.099170
C 2.560093 -1.511535 0.189311
C 3.907820 0.919731 -0.191131
C 3.927214 -1.485753 0.072809
C 4.614286 -0.254446 -0.126107
H -2.478082 -0.470313 1.913818
H -1.969861 1.756749 1.302722
H -4.619846 0.301463 1.229145
H -2.016100 1.274691 -1.715643
H -2.570966 2.680082 -0.801026
H -2.062779 -1.359909 -1.013745
H -2.433548 -2.409188 0.340194
H -4.729551 1.762128 -0.634281
H -4.195048 0.481339 -1.729378
H -0.235818 -2.018330 1.411851
H -0.169793 3.076466 0.050733
H -5.450793 -1.222682 -0.321765
H 2.294189 3.077906 -0.244927
H 0.137905 -2.342252 -1.389305
H 2.040002 -2.464976 0.336556
H 4.416896 1.870825 -0.337464
H 4.506610 -2.406017 0.131401
H 5.698274 -0.264708 -0.221325


%chk=000185542-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185542

0 1
O -4.739641 -1.248832 0.502033
O 0.073263 -2.615743 -0.799931
C -2.499237 -0.264784 0.790913
C -1.823124 1.054034 0.346218
C -3.992129 0.016312 0.522612
C -2.618846 1.483975 -0.944772
C -1.940681 -1.433875 -0.038590
C -4.019452 0.800458 -0.824608
C -0.314976 0.942608 0.163192
C -0.426738 -1.612268 0.179619
C 0.363074 -0.294035 0.126150
C 0.427280 2.168265 0.078004
C 1.816114 -0.311726 0.088874
C 2.543701 0.941502 0.010034
C 1.813717 2.174322 -0.013963
C 2.585877 -1.525673 0.160887
C 3.977103 0.937171 -0.018394
C 3.983447 -1.497541 0.147813
C 4.691224 -0.259690 0.049225
H -2.324355 -0.466901 1.865044
H -2.006321 1.826495 1.121752
H -4.383435 0.665239 1.337715
H -2.087632 1.139920 -1.849860
H -2.692394 2.583514 -1.014796
H -2.118408 -1.246678 -1.116932
H -2.458623 -2.373808 0.210940
H -4.847972 1.530905 -0.860354
H -4.175641 0.077943 -1.646884
H -0.241567 -2.117738 1.147008
H -0.125929 3.115484 0.097914
H -5.702596 -1.052970 0.383034
H 2.366431 3.119248 -0.079339
H 0.053569 -2.201713 -1.700654
H 2.060612 -2.481986 0.202222
H 4.503434 1.897226 -0.085105
H 4.544326 -2.437026 0.209065
H 5.786725 -0.255335 0.031718


