%chk=000193556.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193556

0 1
O -0.178108 -0.137904 0.500940
O 1.480734 0.532515 -0.927273
O 0.801960 2.596590 1.884667
O 3.493034 1.089493 2.511265
O 4.083289 1.830986 -0.749817
O -2.901068 -2.148229 -0.758274
O -1.096978 -3.818339 -1.018879
O 4.041514 -1.797132 -1.439333
O 3.144265 -0.371468 -2.926671
O -0.277810 -2.435380 2.219571
O -1.809206 1.397432 2.456482
O -3.879625 2.660255 -1.113705
N -3.746419 0.509982 -0.372301
C 1.352955 1.352466 1.456115
C 2.869997 1.620312 1.333803
C 0.646946 0.983311 0.129694
C 3.600830 0.880328 0.184569
C -1.400407 -0.322620 -0.247117
C 2.676536 -0.154968 -0.493198
C -1.797261 -1.785848 0.070818
C -2.425299 0.737136 0.233246
C -0.617259 -2.763112 -0.185664
C 3.268181 -0.710049 -1.782437
C -0.036285 -3.323938 1.128130
C -2.562712 0.749006 1.767197
C -4.378366 1.550643 -1.084352
C -5.677173 1.171081 -1.727093
H 1.162245 0.565126 2.228183
H 3.056238 2.721330 1.261996
H 0.068637 1.811314 -0.333900
H 4.537369 0.401905 0.579453
H -1.197994 -0.192707 -1.335252
H 2.407131 -0.984041 0.204834
H -2.200167 -1.891065 1.108133
H -2.054003 1.765525 -0.076860
H 0.175539 -2.298934 -0.820331
H -0.116119 2.450320 2.267411
H 3.354162 1.696816 3.273584
H 3.346527 2.181098 -1.313121
H -4.049042 -0.466690 -0.458060
H 1.047178 -3.521793 1.041177
H -0.545586 -4.256576 1.441177
H -3.388078 0.158211 2.190092
H -2.581806 -2.472910 -1.646050
H -1.804117 -4.335252 -0.561093
H 4.503229 -2.206146 -2.222456
H 0.139814 -1.553926 2.042461
H -5.549234 0.425757 -2.523994
H -6.140889 2.059791 -2.189972
H -6.404300 0.769896 -1.007200


%chk=000193556-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193556

0 1
O -0.251185 -0.102855 0.503637
O 1.736716 0.107662 -0.845556
O 0.679515 2.550308 1.758162
O 3.488914 2.429012 2.175325
O 4.549003 1.368917 -0.806316
O -2.987471 -1.868646 -1.246785
O -1.469104 -3.903705 -1.263292
O 4.727989 -1.907528 -0.345192
O 3.531497 -1.413428 -2.281994
O 0.721281 -2.402670 1.435682
O -1.844762 1.561535 2.329518
O -4.612031 2.409680 0.550128
N -3.751285 0.620677 -0.609684
C 1.447535 1.419306 1.271418
C 2.859452 1.949186 0.951777
C 0.804225 0.813049 0.011707
C 3.775548 0.858828 0.330038
C -1.431297 -0.261777 -0.358181
C 2.932597 -0.375278 -0.102912
C -1.933565 -1.721714 -0.230790
C -2.460622 0.847809 0.049506
C -0.812811 -2.791267 -0.520769
C 3.718957 -1.261789 -1.061749
C -0.123076 -3.359963 0.742378
C -2.653259 0.964519 1.575543
C -4.786603 1.478776 -0.308396
C -6.099279 1.264626 -1.039912
H 1.526832 0.628516 2.049409
H 2.745139 2.777805 0.218248
H 0.336225 1.587710 -0.621749
H 4.528164 0.554607 1.072994
H -1.149964 -0.112847 -1.420419
H 2.629918 -0.992948 0.764494
H -2.368805 -1.905089 0.775189
H -2.033254 1.821856 -0.268147
H -0.064402 -2.378410 -1.218773
H -0.238811 2.250228 2.051583
H 2.843766 3.050895 2.605811
H 3.926084 1.563411 -1.555076
H -3.858552 -0.239568 -1.170292
H 0.533292 -4.196218 0.441787
H -0.912885 -3.757574 1.426157
H -3.530450 0.423061 1.996327
H -2.833959 -2.775649 -1.654325
H -1.701607 -4.635888 -0.635947
H 5.298674 -2.434157 -0.967056
H 0.331662 -1.483182 1.304137
H -6.300635 2.138200 -1.684698
H -6.921832 1.205446 -0.307504
H -6.098479 0.356122 -1.664846


