%chk=000202454.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202454

0 1
O 0.120840 -1.374308 0.519357
O 1.783075 0.721737 -2.442629
N -3.667160 -0.072227 0.050323
C -2.791178 -1.285286 -0.021697
C -3.311304 0.940810 -0.995964
C -5.121578 -0.431373 0.004884
C -2.068391 -1.414515 1.333623
C -1.960663 1.588337 -0.645095
C -5.943075 0.705439 0.640502
C -0.807233 -2.262749 1.221929
C -1.612840 2.713129 -1.614706
C -7.427480 0.357766 0.686032
C 1.273250 -1.908706 -0.011837
C 1.969289 -1.006049 -0.854261
C 1.417907 0.376207 -1.086887
C 1.991171 1.376782 -0.102140
C 1.753290 -3.197825 0.238103
C 3.156151 -1.433585 -1.448104
C 3.646425 -2.726127 -1.211747
C 2.949675 -3.595394 -0.372631
C 1.412868 1.484332 1.170927
C 3.085568 2.179605 -0.444564
C 1.919726 2.406322 2.089395
C 3.588207 3.102841 0.477098
C 3.004553 3.219664 1.742364
H -3.358530 -2.212165 -0.241186
H -2.031430 -1.195217 -0.831529
H -3.280423 0.514160 -2.020764
H -4.102608 1.724318 -1.003644
H -5.276388 -1.362183 0.593211
H -5.485401 -0.640867 -1.023113
H -1.801066 -0.397391 1.700588
H -2.748532 -1.831840 2.098635
H -1.994509 1.972295 0.394315
H -1.148788 0.819957 -0.650542
H -5.561501 0.906734 1.661998
H -5.788262 1.647492 0.077815
H -0.950725 -3.183150 0.632962
H -0.361407 -2.497330 2.203100
H -1.532435 2.352482 -2.646000
H -2.369785 3.506252 -1.603023
H -0.656389 3.178400 -1.347395
H -7.835862 0.182592 -0.315609
H -7.615518 -0.543254 1.280983
H -8.007601 1.171392 1.137097
H 0.288359 0.371209 -1.031974
H 3.691595 -0.748855 -2.111059
H 1.227136 -3.882266 0.892891
H 4.571452 -3.045485 -1.684808
H 3.335543 -4.597314 -0.185470
H 0.577771 0.834452 1.442450
H 3.545230 2.071810 -1.427724
H 1.408696 1.595527 -2.671560
H 1.471301 2.490513 3.077458
H 4.438176 3.727631 0.209672
H 3.396212 3.938774 2.458647


%chk=000202454-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202454

0 1
O 0.302978 -1.366883 -0.036463
O 3.104566 0.748049 -2.311305
N -3.649302 0.307766 -0.056838
C -2.585746 -0.691651 -0.326160
C -3.862147 1.244025 -1.192390
C -4.912698 -0.303895 0.433765
C -1.887939 -1.175801 0.963510
C -2.787592 2.349422 -1.280417
C -5.734629 0.640672 1.337807
C -0.728034 -2.135366 0.687763
C -3.031248 3.305040 -2.468605
C -7.055329 -0.005485 1.809637
C 1.496211 -2.019934 -0.393145
C 2.463298 -1.203018 -1.045060
C 2.167498 0.276431 -1.267229
C 2.318630 1.119210 0.005339
C 1.754203 -3.388329 -0.142454
C 3.677369 -1.789553 -1.457160
C 3.945003 -3.158236 -1.216757
C 2.984154 -3.951477 -0.554833
C 1.207328 1.804490 0.551560
C 3.585949 1.248105 0.630201
C 1.355375 2.609703 1.704106
C 3.736618 2.053442 1.779341
C 2.621014 2.737449 2.320509
H -2.980919 -1.576381 -0.890337
H -1.819825 -0.227236 -0.970944
H -3.913272 0.699080 -2.170427
H -4.846609 1.730451 -1.056644
H -4.656084 -1.206264 1.021234
H -5.554775 -0.656712 -0.414652
H -1.513764 -0.296727 1.518548
H -2.610726 -1.694842 1.623980
H -2.786112 2.909586 -0.326024
H -1.783223 1.891087 -1.378842
H -5.109478 0.922778 2.205934
H -5.956913 1.580524 0.795063
H -1.054457 -2.995229 0.064526
H -0.298432 -2.521547 1.634148
H -3.015873 2.759021 -3.431007
H -4.014628 3.805273 -2.382832
H -2.256787 4.091877 -2.515009
H -7.701276 -0.270473 0.950992
H -6.864532 -0.932356 2.383549
H -7.625804 0.681038 2.461072
H 1.122934 0.381377 -1.627043
H 4.394744 -1.158210 -1.988690
H 1.014674 -4.015965 0.362881
H 4.892143 -3.597949 -1.546659
H 3.181430 -5.011809 -0.360299
H 0.222280 1.696999 0.081489
H 4.445473 0.711569 0.212967
H 3.065272 1.737436 -2.331227
H 0.486954 3.133932 2.118853
H 4.719334 2.147359 2.255659
H 2.738127 3.361631 3.213723


