%chk=000118433.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000118433

0 1
O 3.830644 -1.067911 -2.224227
O 4.023364 -0.453870 2.360290
O 1.710265 1.106638 -0.090038
O -1.887739 -2.240810 0.401998
O -4.220574 4.437458 -0.047556
O -5.589181 2.766080 0.067339
N 3.619307 -0.898117 0.099342
N -0.073574 -0.351014 0.163813
N -4.465528 3.243591 0.016187
C 5.657854 -0.218483 -0.796636
C 5.717099 -0.029320 0.614058
C 2.206367 -1.263347 0.207611
C 4.308784 -0.758991 -1.166987
C 4.409241 -0.438619 1.223387
C 1.314631 -0.021494 0.073500
C -1.153936 0.543349 0.088522
C 6.732666 0.085655 -1.603511
C 6.851274 0.464447 1.221188
C -2.490624 0.029965 0.121927
C 7.899044 0.593852 -0.981985
C 7.956820 0.778383 0.394016
C -0.945326 1.945456 -0.012731
C -3.559820 0.937341 0.110745
C -2.773510 -1.424554 0.185042
C -3.331313 2.312917 0.029898
C -2.010922 2.818813 -0.040612
C -4.178665 -1.888430 -0.026541
C -4.824960 -1.654755 -1.248857
C -4.823818 -2.603188 0.991349
C -6.125197 -2.126279 -1.443920
C -6.128590 -3.064211 0.792568
C -6.778444 -2.825923 -0.422602
H 1.955827 -2.006717 -0.592966
H 2.028627 -1.758946 1.197252
H 6.691552 -0.055753 -2.684703
H 6.900897 0.612847 2.301096
H -0.330348 -1.365002 0.305550
H 8.761157 0.843404 -1.603493
H 8.864372 1.173093 0.854831
H 0.081140 2.339344 -0.063808
H -4.599439 0.576523 0.169954
H -1.855713 3.903435 -0.112377
H -4.314486 -1.113348 -2.045717
H -4.307745 -2.801799 1.931614
H -6.631731 -1.947049 -2.392047
H -6.636572 -3.613425 1.584818
H -7.795577 -3.187137 -0.576079


%chk=000118433-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000118433

0 1
O 3.854879 -1.319650 -2.222627
O 3.835733 -0.183153 2.343459
O 1.756925 1.229982 -0.335528
O -1.824223 -2.031721 0.669140
O -4.305728 4.691440 -0.136979
O -5.719305 2.926757 0.182694
N 3.529374 -0.861098 0.086957
N -0.106687 -0.143369 0.137922
N -4.538771 3.430085 0.018315
C 5.646521 -0.393159 -0.751637
C 5.641492 -0.051760 0.623794
C 2.114063 -1.162126 0.156923
C 4.289727 -0.906118 -1.121126
C 4.280832 -0.333985 1.180355
C 1.256528 0.112971 -0.040840
C -1.182268 0.749329 0.039194
C 6.794655 -0.233314 -1.541286
C 6.784871 0.460496 1.254336
C -2.529479 0.220118 0.154551
C 7.956309 0.286456 -0.912952
C 7.951382 0.627961 0.463406
C -0.987806 2.149048 -0.157473
C -3.613909 1.130805 0.163779
C -2.779417 -1.244925 0.310366
C -3.386051 2.506731 0.000779
C -2.081200 3.023495 -0.178089
C -4.123593 -1.844551 0.045645
C -4.983993 -1.388059 -0.991335
C -4.498800 -2.985396 0.807979
C -6.204629 -2.049889 -1.242715
C -5.726531 -3.630994 0.567108
C -6.584307 -3.163400 -0.458365
H 1.872606 -1.889937 -0.639852
H 1.884724 -1.615102 1.138767
H 6.785977 -0.499243 -2.602837
H 6.769327 0.721930 2.316924
H -0.417007 -1.104732 0.415714
H 8.871237 0.428155 -1.497983
H 8.862645 1.028325 0.920344
H 0.030802 2.521976 -0.273839
H -4.637519 0.785254 0.323814
H -1.943503 4.099856 -0.311229
H -4.686335 -0.548081 -1.627156
H -3.813993 -3.347956 1.581201
H -6.855046 -1.699149 -2.050659
H -6.015527 -4.497621 1.170913
H -7.537381 -3.668584 -0.649372


