%chk=000288449.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288449

0 1
O -0.361629 -1.012426 0.079497
O -1.821792 4.828516 0.093570
O -0.081436 -0.695849 2.306989
O 6.223209 1.699279 0.159548
O 5.179530 2.667678 -1.469503
N 5.221157 1.938006 -0.493333
C -2.624169 -0.736671 -0.641478
C -1.711490 -1.573894 0.289751
C -2.438446 0.743317 -0.389572
C -1.629379 -3.025772 -0.108833
C -4.085582 -1.150206 -0.449170
C -2.018538 1.573966 -1.446105
C -2.671239 1.303758 0.872747
C -2.370979 -3.981431 0.600796
C -0.824675 -3.423571 -1.185620
C -1.823610 2.935376 -1.247833
C -2.483052 2.670323 1.100227
C -2.059000 3.473167 0.034876
C 0.326243 -0.564855 1.177436
C -2.311841 -5.326586 0.226288
C -0.764817 -4.770597 -1.552434
C -1.510192 -5.722604 -0.849512
C 1.597245 0.076030 0.724814
C 2.774962 -0.174289 1.443477
C 1.591269 0.932602 -0.384209
C 3.965938 0.434225 1.044935
C 2.778743 1.547849 -0.785711
C 3.954310 1.289023 -0.067208
C -2.026170 5.497169 1.361657
H -2.327891 -0.966228 -1.699113
H -1.982486 -1.448095 1.364347
H -4.240189 -2.206869 -0.700931
H -4.743835 -0.557904 -1.097993
H -4.430304 -0.997710 0.579468
H -1.845023 1.147710 -2.434865
H -2.998459 0.671432 1.699244
H -2.990186 -3.681232 1.444718
H -0.238060 -2.677321 -1.722911
H -1.504127 3.592713 -2.053137
H -2.664460 3.083161 2.086939
H -2.888676 -6.068230 0.776754
H -0.136181 -5.078405 -2.386585
H -1.464468 -6.771542 -1.137347
H 2.756529 -0.836247 2.313908
H 0.656947 1.115352 -0.927467
H 4.900605 0.254728 1.588442
H 2.799833 2.223885 -1.648164
H -1.347206 5.094057 2.118447
H -1.765139 6.534179 1.111823
H -3.073187 5.419933 1.667835


%chk=000288449-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288449

0 1
O -0.313645 -0.803892 -0.114843
O -2.398858 5.097878 0.194186
O 0.284081 -1.219521 2.106082
O 6.589443 1.565046 0.607822
O 5.841307 2.113066 -1.475867
N 5.678167 1.592123 -0.306065
C -2.659853 -0.601084 -0.747872
C -1.675928 -1.412299 0.134567
C -2.581702 0.898306 -0.454439
C -1.607768 -2.899593 -0.170652
C -4.102456 -1.144048 -0.562017
C -2.286328 1.821742 -1.490884
C -2.823441 1.414921 0.841228
C -1.878818 -3.844318 0.848343
C -1.272370 -3.362090 -1.469548
C -2.234571 3.206992 -1.249132
C -2.772473 2.801318 1.108539
C -2.476941 3.702920 0.055670
C 0.563549 -0.779611 0.962992
C -1.833099 -5.229794 0.574094
C -1.218195 -4.745120 -1.743622
C -1.503485 -5.683756 -0.723255
C 1.877150 -0.159241 0.596691
C 2.908656 -0.165460 1.571053
C 2.098976 0.429494 -0.675114
C 4.160639 0.405975 1.282131
C 3.345883 1.008176 -0.976522
C 4.357837 0.984393 0.008464
C -2.634414 5.659406 1.526221
H -2.368571 -0.758585 -1.805181
H -1.905695 -1.263683 1.205710
H -4.170509 -2.212049 -0.833635
H -4.802574 -0.574712 -1.197492
H -4.437681 -1.032974 0.486114
H -2.094348 1.449227 -2.504804
H -3.053931 0.733321 1.669787
H -2.112747 -3.493378 1.860209
H -1.038983 -2.640519 -2.261139
H -2.008415 3.920362 -2.047500
H -2.960746 3.161097 2.124558
H -2.044694 -5.951621 1.370578
H -0.952991 -5.093444 -2.748127
H -1.462499 -6.757644 -0.936960
H 2.706301 -0.622139 2.544675
H 1.289170 0.433758 -1.408615
H 4.975866 0.413901 2.009797
H 3.548719 1.473071 -1.944453
H -1.889851 5.288747 2.257637
H -2.522850 6.746621 1.403263
H -3.655707 5.427616 1.886826


