%chk=000297864.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297864

0 1
O -6.196610 -1.385719 -0.366089
O -5.402977 -1.496659 1.753233
O -3.137540 1.576504 -1.318993
O 4.174000 2.005754 -1.049763
O 0.640236 2.808017 0.939459
O 2.364120 1.346283 -2.299532
N 0.430313 -0.540781 -0.929748
N -3.444897 0.388096 0.619324
N -1.254833 3.220412 -0.285152
N 2.392247 3.382655 -1.128007
C -2.915751 -1.966553 -0.123248
C -1.523348 -1.459097 -0.186260
C -3.935313 -0.799217 -0.118691
C -0.652549 -1.284192 0.951006
C 0.564541 -0.704916 0.458435
C -0.841863 -1.001673 -1.309215
C -0.778757 -1.549993 2.329651
C -5.217533 -1.254439 0.586406
C 1.639368 -0.388231 1.317524
C 0.276215 -1.236180 3.165278
C 1.474877 -0.658072 2.661684
C -2.922625 1.453189 -0.123340
C -2.140551 2.510533 0.661555
C -7.506762 -1.820902 0.089307
C 0.130355 3.146946 -0.111982
C 0.949442 3.624647 -1.317655
C 4.673935 -0.367154 -0.862152
C 4.983049 0.907002 -1.590605
C 2.896355 2.140511 -1.542861
C 5.275471 -0.636227 0.375450
C 3.781731 -1.293068 -1.423119
C 4.990914 -1.830929 1.043044
C 3.500404 -2.485464 -0.752076
C 4.105457 -2.755850 0.480241
H -3.133256 -2.633607 -0.983790
H -3.041805 -2.599105 0.783476
H -4.171326 -0.495480 -1.183655
H -1.173255 -0.964137 -2.333147
H 1.124110 -0.136464 -1.548565
H -3.085401 0.189166 1.557375
H -1.691124 -1.999317 2.714203
H 2.553827 0.051385 0.925936
H 0.204272 -1.429446 4.233532
H 2.273654 -0.424567 3.364162
H -2.849596 3.238065 1.124876
H -1.538882 2.073104 1.499971
H -1.667534 3.359403 -1.214727
H -8.083750 -1.849903 -0.841215
H -7.908258 -1.089085 0.797345
H -7.425293 -2.807977 0.554278
H 0.606301 3.123006 -2.258621
H 0.802524 4.722114 -1.470922
H 2.790315 3.787476 -0.271207
H 4.809538 0.838393 -2.680558
H 6.001179 1.294499 -1.388819
H 5.958156 0.086334 0.820462
H 3.301552 -1.072769 -2.378362
H 5.456790 -2.039460 2.004904
H 2.801533 -3.201101 -1.183855
H 3.879708 -3.683460 1.004913


%chk=000297864-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297864

0 1
O -5.281827 -1.474949 1.396671
O -3.728194 -0.305802 2.676969
O -3.253830 2.572824 -1.326260
O 4.278119 1.667617 -1.762747
O 1.236018 3.214530 0.326077
O 2.092136 1.002396 -2.342700
N 0.053894 -0.706246 -1.283794
N -3.182625 1.410557 0.697583
N -0.777377 3.636072 -0.776470
N 2.680543 3.252904 -2.058967
C -3.660425 -0.511027 -0.916596
C -2.201060 -0.871281 -0.904929
C -4.130842 0.351158 0.329295
C -1.532799 -1.946698 -0.191237
C -0.116159 -1.807962 -0.440967
C -1.194418 -0.150298 -1.556439
C -1.984105 -3.021472 0.622197
C -4.333379 -0.486338 1.592167
C 0.837666 -2.687405 0.119449
C -1.037667 -3.907263 1.171931
C 0.358900 -3.736768 0.929396
C -2.770868 2.390019 -0.159337
C -1.640218 3.301486 0.362676
C -5.542583 -2.355052 2.565773
C 0.590724 3.499701 -0.727433
C 1.306664 3.738967 -2.088080
C 4.488407 -0.335544 -0.275519
C 4.682919 0.247409 -1.669575
C 2.934009 1.903105 -2.071013
C 3.705283 0.300837 0.717297
C 5.099241 -1.582633 0.015771
C 3.534744 -0.308491 1.982433
C 4.926032 -2.189311 1.278949
C 4.140310 -1.552428 2.268167
H -3.882142 0.101305 -1.806569
H -4.311932 -1.403177 -0.946417
H -5.107412 0.794075 0.052189
H -1.291588 0.719775 -2.202830
H 0.936126 -0.301189 -1.622526
H -2.712758 1.272658 1.600905
H -3.055696 -3.169819 0.803897
H 1.910923 -2.555859 -0.057481
H -1.372209 -4.743617 1.796726
H 1.072423 -4.435880 1.380424
H -2.085661 4.215177 0.803876
H -1.015376 2.815984 1.131520
H -1.273569 3.737870 -1.669931
H -6.276697 -3.087710 2.204202
H -5.947948 -1.761008 3.401473
H -4.606920 -2.843522 2.885239
H 0.754931 3.225380 -2.895399
H 1.314732 4.819875 -2.314677
H 3.417483 3.853441 -1.687258
H 4.105822 -0.329648 -2.417252
H 5.747504 0.252892 -1.955782
H 3.229539 1.267864 0.523157
H 5.713498 -2.081590 -0.745343
H 2.919618 0.190122 2.739027
H 5.404520 -3.152117 1.490963
H 4.000655 -2.021594 3.248226


