%chk=000266194.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266194

0 1
O 1.889582 2.074407 -0.295574
O -1.890146 -2.075287 0.295580
O -0.827606 2.423829 -0.808637
O 0.827022 -2.424676 0.808712
N 2.714992 -0.655507 0.390750
N -2.715566 0.654626 -0.390765
C 1.436906 -0.228259 0.173127
C -1.437479 0.227377 -0.173156
C 3.934817 0.103623 0.317154
C -3.935390 -0.104505 -0.317191
C 5.047702 -0.474131 -0.340563
C -5.048290 0.473249 0.340503
C 0.994583 1.018373 -0.205680
C -0.995155 -1.019253 0.205649
C -0.402264 1.349449 -0.426151
C 0.401694 -1.350334 0.426105
C 4.955201 -1.799901 -1.047419
C -4.955805 1.799019 1.047365
C 4.045206 1.346312 0.961952
C -4.045769 -1.347197 -0.961984
C 6.262603 0.224172 -0.327314
C -6.263190 -0.225053 0.327235
C 4.926283 -2.972119 -0.067099
C -4.926860 2.971241 0.067051
C 5.265231 2.023709 0.950816
C -5.265792 -2.024597 -0.950864
C 6.373625 1.462603 0.310218
C -6.374200 -1.463489 -0.310292
C 2.102228 2.556528 -1.653064
C -2.102830 -2.557310 1.653098
H 2.840503 -1.667495 0.606773
H -2.841081 1.666623 -0.606763
H 5.811268 -1.923617 -1.743961
H 4.054800 -1.823007 -1.698064
H -4.055423 1.822121 1.698036
H -5.811890 1.922734 1.743884
H 3.172018 1.789138 1.450799
H -3.172573 -1.790025 -1.450817
H 7.133410 -0.204653 -0.822364
H -7.134007 0.203774 0.822266
H 5.779081 -2.940359 0.622342
H 4.965437 -3.931487 -0.597082
H 4.011905 -2.979429 0.543392
H -5.779634 2.939481 -0.622418
H -4.966035 3.930607 0.597035
H -4.012461 2.978558 -0.543411
H 5.349783 2.990029 1.446107
H -5.350332 -2.990922 -1.446148
H 7.325875 1.990340 0.307335
H -7.326449 -1.991228 -0.307423
H 2.866906 3.324982 -1.498318
H 2.468214 1.749390 -2.289162
H 1.172530 2.991639 -2.035229
H -2.468829 -1.750125 2.289130
H -2.867506 -3.325772 1.498386
H -1.173141 -2.992395 2.035315


%chk=000266194-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266194

0 1
O 1.786651 2.189601 -0.572452
O -1.787191 -2.191452 0.573061
O -1.061790 2.483620 -0.428668
O 1.061182 -2.485549 0.428271
N 2.749885 -0.560313 0.048758
N -2.750385 0.558794 -0.048570
C 1.443423 -0.144998 -0.006040
C -1.443988 0.143308 0.006957
C 3.998969 0.109487 0.166669
C -3.999656 -0.110398 -0.168194
C 5.164155 -0.591317 -0.285444
C -5.164671 0.590007 0.284983
C 0.919449 1.117084 -0.303430
C -0.920032 -1.118793 0.304458
C -0.510897 1.328742 -0.251291
C 0.510395 -1.330258 0.253266
C 5.076402 -1.966953 -0.935670
C -5.076471 1.964224 0.938144
C 4.121057 1.376346 0.797584
C -4.122187 -1.375798 -0.801968
C 6.424493 0.024487 -0.101843
C -6.425247 -0.024807 0.099715
C 5.015121 -3.134290 0.091245
C -5.014231 3.133697 -0.086276
C 5.391148 1.961357 0.964723
C -5.392510 -1.959847 -0.970722
C 6.551141 1.289213 0.514317
C -6.552316 -1.288159 -0.519163
C 1.518432 2.975538 -1.798691
C -1.519772 -2.977135 1.799646
H 2.770878 -1.594508 0.145842
H -2.771073 1.593120 -0.144298
H 5.967008 -2.113727 -1.574203
H 4.198603 -2.023390 -1.608243
H -4.198887 2.018803 1.611151
H -5.967232 2.110095 1.576667
H 3.227305 1.898404 1.142489
H -3.228631 -1.897482 -1.147899
H 7.320221 -0.499663 -0.457094
H -7.320830 0.499017 0.455813
H 5.892890 -3.107984 0.761243
H 5.005494 -4.107929 -0.431180
H 4.110513 -3.093758 0.726299
H -5.891765 3.109251 -0.756653
H -5.004306 4.106224 0.438210
H -4.109407 3.094050 -0.721079
H 5.472741 2.938329 1.453230
H -5.474428 -2.935691 -1.461424
H 7.539730 1.743316 0.641883
H -7.541084 -1.741515 -0.647998
H 2.369097 3.669805 -1.874986
H 1.492337 2.311417 -2.683699
H 0.567900 3.524598 -1.702623
H -1.494469 -2.312847 2.684551
H -2.370390 -3.671520 1.875416
H -0.569077 -3.526050 1.704413


