%chk=000250552.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250552

0 1
O -1.756261 -0.250753 0.523220
O 2.410330 -1.140244 -0.290367
O -0.089075 -0.124722 -2.199543
O 0.030049 -2.238365 -2.634901
O -1.561056 1.994464 0.311738
O 2.384579 -0.582330 1.895054
N -0.025858 -1.289927 -1.869989
C 0.001410 -1.637838 -0.353856
C -1.040137 -2.761339 -0.139121
C -0.308706 -0.384023 0.481630
C 1.420416 -2.165814 -0.045479
C -1.099732 -3.260918 1.298039
C -2.282439 1.030061 0.393444
C 2.841281 -0.378236 0.792804
C -3.761782 0.968027 0.398411
C 3.850080 0.605744 0.357786
C -4.469880 2.139946 0.084662
C 4.527671 1.339783 1.347246
C -4.449415 -0.214958 0.708190
C 4.126192 0.821990 -1.001532
C -5.866182 2.122415 0.079894
C 5.483677 2.284170 0.971348
C -5.846000 -0.223584 0.702803
C 5.083789 1.770538 -1.367979
C -6.552768 0.942747 0.388331
C 5.760922 2.499191 -0.384213
H -0.825746 -3.603946 -0.832019
H -2.042666 -2.372262 -0.430268
H 0.146326 0.537704 0.054910
H 0.013221 -0.508796 1.535579
H 1.726114 -2.967759 -0.749126
H 1.491408 -2.525227 1.001791
H -1.381508 -2.456755 1.992701
H -0.146946 -3.678875 1.642122
H -1.853731 -4.052555 1.400687
H -3.921721 3.056140 -0.152838
H 4.298026 1.167052 2.402092
H -3.887409 -1.119641 0.952038
H 3.588507 0.250073 -1.763673
H -6.419581 3.028505 -0.164401
H 6.011604 2.856401 1.733464
H -6.384888 -1.139000 0.942912
H 5.299296 1.944077 -2.422095
H -7.643094 0.932267 0.383669
H 6.506983 3.240174 -0.674267


%chk=000250552-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250552

0 1
O -1.827117 -0.389161 0.356717
O 2.397069 -1.126788 -0.334736
O -0.376923 -0.478807 -2.280164
O 0.143819 -2.675281 -2.556550
O -1.542472 1.868885 0.862911
O 2.730238 -0.710958 1.941783
N -0.087694 -1.640384 -1.826705
C 0.012603 -1.859318 -0.266003
C -0.921890 -3.060584 0.064603
C -0.360541 -0.555103 0.444816
C 1.486470 -2.239198 0.008083
C -1.054089 -3.358885 1.574153
C -2.304326 0.917003 0.571255
C 2.980089 -0.423889 0.745615
C -3.783988 1.002455 0.423398
C 3.891797 0.650802 0.276392
C -4.400135 2.260629 0.652704
C 4.567494 1.423815 1.257869
C -4.576601 -0.119122 0.065507
C 4.090357 0.920476 -1.103671
C -5.797371 2.395123 0.526038
C 5.438803 2.457303 0.860736
C -5.974573 0.020505 -0.060127
C 4.962946 1.957222 -1.493943
C -6.587105 1.275505 0.170017
C 5.637835 2.725432 -0.515226
H -0.545008 -3.947005 -0.476207
H -1.921679 -2.830815 -0.343965
H 0.134587 0.316592 -0.012022
H -0.065033 -0.614103 1.507517
H 1.777879 -3.078693 -0.642082
H 1.612993 -2.496937 1.073363
H -1.497093 -2.506675 2.117253
H -0.087536 -3.608972 2.046395
H -1.722609 -4.226412 1.716466
H -3.767868 3.112149 0.925074
H 4.394626 1.200660 2.315783
H -4.092360 -1.082918 -0.113163
H 3.561857 0.321622 -1.850021
H -6.270922 3.366733 0.702488
H 5.959485 3.054030 1.617027
H -6.586477 -0.844129 -0.338854
H 5.115244 2.169026 -2.557454
H -7.673299 1.380772 0.070866
H 6.313819 3.531002 -0.823039


