%chk=000269322.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269322

0 1
O 6.512701 -0.249440 -2.695417
O 2.442618 0.731041 -2.124980
O 6.519472 -1.320997 -0.725152
O 6.922156 1.767189 3.299182
O 7.689308 2.892687 1.522722
N -1.734293 -2.818717 1.299651
N 3.840792 -0.076055 -0.518776
N -6.655573 1.178064 0.031210
N -5.073376 2.472054 -1.348538
N -2.988633 1.635326 -1.955014
N -7.250202 3.267672 -0.896184
C -2.930135 -3.129378 0.458899
C 5.010561 0.618311 -1.078346
C 5.609742 1.657109 -0.114092
C -3.888753 -1.971542 0.326164
C -0.694589 -2.058767 0.721267
C 6.054320 1.074869 1.228544
C 1.484549 -0.702268 -0.452428
C -3.556586 -0.856857 -0.414140
C -4.452705 0.236614 -0.528472
C -0.420703 -2.185980 -0.668049
C 0.160036 -1.243164 1.506954
C -5.158361 -2.035075 0.980994
C 2.574417 0.048653 -1.123113
C -2.085451 -2.554902 2.720486
C -5.727521 0.163690 0.114780
C 0.649849 -1.515326 -1.239016
C 1.232424 -0.581279 0.921721
C -6.056041 -1.006564 0.881186
C 6.070296 -0.437283 -1.416253
C -4.172404 1.454685 -1.267483
C 6.970078 2.019949 1.944998
C -6.306932 2.273252 -0.717468
H -3.431245 -4.017222 0.910530
H -2.586883 -3.467664 -0.549210
H 4.696950 1.146431 -2.036721
H 6.469309 2.163648 -0.612254
H 4.858740 2.459757 0.053029
H 3.998889 -0.682354 0.281983
H 6.588083 0.099070 1.091444
H 5.180642 0.828452 1.871001
H -2.591719 -0.802797 -0.921918
H -5.404705 -2.924481 1.562757
H -1.044169 -2.831617 -1.286917
H -0.017161 -1.122783 2.572892
H -1.185557 -2.645341 3.352777
H -2.539472 -1.562017 2.879111
H -2.802148 -3.317275 3.069506
H 0.848423 -1.610957 -2.310116
H 1.869962 0.054969 1.538463
H -7.032973 -1.039073 1.366258
H -2.800063 2.527329 -2.393350
H -2.197990 1.035128 -1.790194
H 7.211571 -0.906049 -2.970142
H 7.533985 2.351600 3.822230
H -6.974853 4.143230 -1.312600
H -8.094074 3.250242 -0.344198


%chk=000269322-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269322

0 1
O 7.987216 -0.943652 -0.825288
O 3.216814 -0.129756 -2.320866
O 6.566265 -1.968176 0.697630
O 6.023790 3.569575 1.975160
O 5.969311 3.957148 -0.313377
N -1.831878 -2.568897 0.985321
N 4.352166 -0.848701 -0.435178
N -7.098550 1.194561 -0.167457
N -5.391384 2.958599 -0.023947
N -3.118934 2.511464 0.118339
N -7.663983 3.465686 -0.170626
C -2.993029 -2.874934 0.129976
C 5.637667 -0.417011 -0.991277
C 5.866067 1.123121 -0.893571
C -4.056509 -1.774778 0.073821
C -0.612589 -2.123724 0.469536
C 5.839532 1.636637 0.555862
C 1.914747 -1.189517 -0.561466
C -3.704032 -0.417348 0.119440
C -4.691982 0.602615 0.026843
C -0.476437 -1.687041 -0.891354
C 0.554923 -2.063862 1.298617
C -5.438429 -2.122364 -0.055418
C 3.181860 -0.686851 -1.171883
C -1.993472 -2.811210 2.426649
C -6.088155 0.248224 -0.095800
C 0.755881 -1.235993 -1.382074
C 1.781923 -1.607028 0.789525
C -6.430052 -1.141006 -0.135773
C 6.734155 -1.196813 -0.276514
C -4.407311 2.034002 0.041271
C 5.948046 3.145617 0.636567
C -6.694293 2.489147 -0.117727
H -3.461390 -3.809127 0.498393
H -2.629534 -3.109498 -0.888054
H 5.666784 -0.669860 -2.070250
H 6.829005 1.367975 -1.374358
H 5.070200 1.605213 -1.485438
H 4.390168 -1.447775 0.393750
H 6.656383 1.207259 1.167948
H 4.897088 1.337308 1.055062
H -2.645012 -0.162155 0.246478
H -5.723166 -3.182272 -0.084929
H -1.342353 -1.678467 -1.560504
H 0.505806 -2.388362 2.341496
H -1.485386 -3.741125 2.756740
H -1.596382 -1.967943 3.021405
H -3.067538 -2.899818 2.655968
H 0.851329 -0.893096 -2.417929
H 2.634450 -1.566759 1.478913
H -7.489730 -1.398825 -0.223141
H -2.987737 3.521166 0.110738
H -2.308811 1.899419 0.115296
H 8.679917 -1.465808 -0.336850
H 6.085587 4.563303 1.997504
H -7.386455 4.442416 -0.145908
H -8.637962 3.186895 -0.247092


