%chk=000269631.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269631

0 1
O -5.525997 1.379445 -0.766847
O 1.160348 1.384413 0.431969
N -3.709615 -0.156887 0.854272
N -0.035315 -1.892576 -0.386421
N 2.366061 -0.515548 -0.084003
C -3.816249 1.326955 0.982550
C -5.001433 -0.723653 0.366583
C -4.283076 1.969907 -0.333174
C -5.447866 -0.049300 -0.941549
C -2.506623 -0.702374 0.351335
C -1.288527 0.021397 0.434388
C -2.444097 -2.033159 -0.123362
C -0.100940 -0.605904 0.063653
C -1.202883 -2.579921 -0.468677
C 1.188197 0.196628 0.155579
C 3.694131 0.019982 -0.048298
C 3.962535 1.363498 0.263143
C 4.750783 -0.870014 -0.340006
C 5.285673 1.808478 0.281614
C 6.064155 -0.402494 -0.315257
C 6.338224 0.934315 -0.005417
H -2.849295 1.763376 1.319718
H -4.553423 1.531736 1.794133
H -5.758187 -0.545356 1.166752
H -4.926201 -1.825702 0.244225
H -4.561865 3.032138 -0.207957
H -3.533393 1.868979 -1.137330
H -4.767630 -0.275267 -1.781054
H -6.486886 -0.307335 -1.215651
H -1.260506 1.056052 0.789108
H -3.343875 -2.638328 -0.207836
H -1.123811 -3.612366 -0.832580
H 2.287628 -1.513756 -0.331048
H 3.144510 2.055689 0.488624
H 4.551085 -1.910786 -0.582509
H 5.495017 2.850697 0.523203
H 6.882370 -1.086239 -0.539658
H 7.364975 1.290681 0.011687


%chk=000269631-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269631

0 1
O -6.278303 1.237867 0.064031
O 1.273553 1.662099 0.273517
N -3.649598 0.002343 0.016679
N 0.244803 -1.792575 -0.180846
N 2.463874 -0.371317 0.004771
C -3.856900 1.353463 0.595962
C -4.879044 -0.823135 -0.006370
C -5.061551 2.055165 -0.053078
C -6.055437 -0.040463 -0.621878
C -2.381752 -0.585672 -0.020952
C -1.182833 0.188271 0.089183
C -2.194051 -1.996879 -0.196628
C 0.066416 -0.441766 0.000731
C -0.894297 -2.532230 -0.273096
C 1.321763 0.401228 0.108691
C 3.821006 0.026865 0.049325
C 4.220857 1.383046 0.204985
C 4.809537 -0.989065 -0.071503
C 5.595777 1.699014 0.235828
C 6.178040 -0.655687 -0.038365
C 6.581494 0.692043 0.115480
H -2.963714 1.977081 0.442067
H -4.029905 1.267086 1.690644
H -5.145133 -1.150018 1.022717
H -4.716280 -1.722236 -0.623072
H -5.283828 3.000205 0.468021
H -4.849439 2.261384 -1.124471
H -5.857495 0.143051 -1.700445
H -6.993024 -0.609124 -0.511181
H -1.166127 1.271007 0.231180
H -3.036019 -2.689324 -0.258194
H -0.759992 -3.611645 -0.406350
H 2.237123 -1.372889 -0.124317
H 3.455562 2.156401 0.297739
H 4.500640 -2.035166 -0.191046
H 5.897610 2.745806 0.355555
H 6.929241 -1.447868 -0.132549
H 7.645427 0.951035 0.141136


