%chk=000260119.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260119

0 1
O -2.551222 -3.562537 0.625321
O 1.543838 -3.078021 0.878892
O -0.156518 -4.344576 1.246493
O -5.137698 1.903825 -1.282981
O -5.282486 -0.294194 -0.616835
N 1.299095 -0.750605 -0.149981
N -2.829493 -1.453707 -0.084906
N 0.319825 -3.298081 0.859266
N -3.229227 0.823075 -0.818663
C 1.906393 0.533496 -0.604615
C 3.371850 0.266221 -0.908322
C 1.759276 1.654404 0.414789
C -0.041131 -0.984115 -0.074929
C -0.534885 -2.256105 0.368721
C 3.797442 0.217320 -2.243567
C 1.823611 2.977788 -0.050125
C 4.293779 0.059588 0.127202
C 1.580932 1.406551 1.781220
C -0.973315 0.034034 -0.450727
C -2.335007 -0.219907 -0.443688
C -1.949827 -2.554996 0.347548
C 5.140750 -0.031379 -2.538235
C 1.703684 4.041254 0.847029
C 5.635389 -0.192146 -0.173220
C 1.457189 2.475528 2.674992
C 6.060569 -0.236897 -1.504666
C 1.517369 3.792402 2.211306
C -4.638079 0.698409 -0.872768
C -6.607803 2.017071 -1.362268
C -7.197733 2.091312 0.024847
H 1.379248 0.846391 -1.553808
H 1.971422 -1.499044 0.156059
H 3.086847 0.366066 -3.054998
H 1.981140 3.180766 -1.108211
H 3.968201 0.098108 1.167427
H 1.534011 0.384806 2.159494
H -0.602245 1.020448 -0.714220
H -3.851288 -1.656982 -0.095957
H 5.470251 -0.069930 -3.575721
H 1.758922 5.066529 0.483744
H 6.349437 -0.356220 0.633372
H 1.315404 2.277025 3.737139
H 7.106232 -0.434692 -1.736747
H 1.423184 4.622426 2.909491
H -2.817870 1.735552 -1.060353
H -6.986486 1.162916 -1.951499
H -6.685576 2.963174 -1.931819
H -8.267968 2.336632 -0.007934
H -7.104495 1.131213 0.558009
H -6.704539 2.854206 0.642202


%chk=000260119-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000260119

0 1
O -2.587897 -3.679296 0.312829
O 1.666909 -3.173532 0.508306
O -0.111640 -4.529057 0.907896
O -5.134742 1.951243 -1.199270
O -5.261753 -0.341321 -0.674646
N 1.328321 -0.733820 -0.152127
N -2.789191 -1.450152 -0.231190
N 0.348717 -3.387589 0.541693
N -3.215135 0.832459 -0.792220
C 1.945818 0.553177 -0.538988
C 3.429015 0.289174 -0.861161
C 1.731929 1.668386 0.495436
C -0.013704 -0.994473 -0.151789
C -0.534116 -2.310194 0.167207
C 3.747927 -0.388629 -2.066109
C 1.760108 3.019878 0.068665
C 4.474859 0.669037 0.012542
C 1.539613 1.384406 1.868429
C -0.938720 0.057251 -0.472341
C -2.304673 -0.199190 -0.496792
C -1.977330 -2.594016 0.112521
C 5.088782 -0.683220 -2.392197
C 1.599923 4.071270 0.998013
C 5.818980 0.374982 -0.313258
C 1.378402 2.434584 2.800777
C 6.130242 -0.300891 -1.514136
C 1.407941 3.780824 2.369622
C -4.602873 0.714828 -0.866784
C -6.631693 2.022741 -1.281991
C -7.239688 2.277650 0.097658
H 1.469327 0.884280 -1.488159
H 1.912935 -1.569375 0.075797
H 2.942381 -0.695050 -2.745189
H 1.921304 3.249599 -0.992637
H 4.243177 1.196715 0.943613
H 1.510437 0.341746 2.203767
H -0.579312 1.070996 -0.647803
H -3.807978 -1.617133 -0.268598
H 5.321224 -1.210267 -3.323991
H 1.625593 5.111903 0.655675
H 6.620633 0.672182 0.371839
H 1.229489 2.201515 3.860925
H 7.172272 -0.529035 -1.764110
H 1.282171 4.594380 3.092594
H -2.830031 1.761949 -0.971693
H -6.997677 1.078417 -1.720563
H -6.802978 2.858615 -1.977838
H -8.333087 2.407616 -0.002395
H -7.058722 1.425010 0.773190
H -6.825087 3.193829 0.551781


