%chk=000183921.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183921

0 1
O 2.144185 1.987950 -0.057804
O -3.041629 0.789612 0.282068
O 1.528640 1.101840 1.949785
O 4.147538 2.154583 -1.074101
O -2.688390 2.136108 -1.499918
C -0.855438 -0.314666 0.413546
C -0.080804 -1.531992 -0.200426
C -0.100416 1.008397 0.114308
C -2.228372 -0.277030 -0.319961
C 1.347283 0.920793 0.559316
C 1.342857 -1.643888 0.394555
C 2.058095 -0.372642 0.141240
C -0.890384 -2.807795 -0.089691
C -1.060278 -0.462335 1.923425
C -3.061328 -1.541699 -0.091881
C -2.232885 -2.786514 -0.077507
C 3.198375 -0.071943 -0.503833
C -0.148043 -4.106429 -0.065047
C 3.322769 1.424936 -0.613053
C 4.237154 -0.945055 -1.079353
C -3.209788 1.960845 -0.423413
C -4.086755 2.875273 0.356609
H 0.038399 -1.336126 -1.302179
H -0.610311 1.850967 0.623273
H -0.146715 1.264398 -0.966611
H -2.101151 -0.053859 -1.403771
H 1.888437 -2.501655 -0.046679
H 1.290727 -1.840939 1.488914
H -1.829604 0.234021 2.282026
H -1.381661 -1.473183 2.196155
H -0.138915 -0.244257 2.483235
H -3.851612 -1.614754 -0.867339
H -3.607644 -1.447854 0.875472
H -2.815516 -3.706608 -0.039705
H 0.373749 -4.246635 0.892438
H 0.599488 -4.163910 -0.867603
H -0.812911 -4.972235 -0.191105
H 1.566180 2.063404 2.169967
H 4.908795 -1.330844 -0.294577
H 4.871859 -0.408609 -1.804872
H 3.805775 -1.812488 -1.599735
H -3.585198 3.839790 0.535687
H -4.373639 2.454835 1.333665
H -5.013015 3.093693 -0.199218


%chk=000183921-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183921

0 1
O 2.361335 1.984907 0.197726
O -2.803416 1.098013 0.283735
O 1.703994 0.919525 2.226893
O 4.353455 2.051527 -1.038426
O -3.876884 1.354622 -1.774327
C -0.764487 -0.262126 0.545002
C -0.022577 -1.476671 -0.132099
C 0.074322 1.039531 0.327191
C -2.101973 -0.124535 -0.229518
C 1.535114 0.885611 0.787172
C 1.407952 -1.676562 0.476685
C 2.168384 -0.400250 0.273552
C -0.888878 -2.743815 -0.162590
C -1.040404 -0.508264 2.052261
C -3.020243 -1.346678 -0.053610
C -2.247721 -2.648729 -0.149738
C 3.290752 -0.109342 -0.443025
C -0.196605 -4.086830 -0.300021
C 3.466313 1.379394 -0.486587
C 4.263501 -1.009681 -1.147715
C -3.677696 1.743686 -0.601513
C -4.329831 2.931228 0.072242
H 0.152110 -1.188883 -1.196073
H -0.402411 1.887544 0.852976
H 0.088951 1.292235 -0.750655
H -1.902599 0.040920 -1.306627
H 1.920846 -2.518759 -0.017564
H 1.327942 -1.919667 1.553408
H -1.700616 0.285967 2.443918
H -1.536865 -1.480183 2.211739
H -0.107842 -0.492071 2.637426
H -3.816404 -1.316644 -0.821399
H -3.531015 -1.280312 0.929085
H -2.848480 -3.566397 -0.214157
H 0.449357 -4.310310 0.570916
H 0.453622 -4.118017 -1.197244
H -0.933369 -4.903280 -0.390548
H 1.353186 1.784545 2.562956
H 5.272599 -0.903511 -0.708528
H 4.356670 -0.730233 -2.212993
H 3.965642 -2.069263 -1.080971
H -4.824884 3.559727 -0.681973
H -3.585891 3.519657 0.633541
H -5.087053 2.577877 0.795780


