%chk=000202282.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202282

0 1
O 5.392818 -1.235742 -0.004883
N -0.314259 2.208386 0.898380
C -0.694948 1.296370 -0.242596
C -0.167539 1.879730 -1.574429
C -0.138927 -0.108197 -0.038605
C -0.718966 3.289863 -1.809431
C -0.903103 3.576201 0.697286
C -0.382522 4.187897 -0.613240
C -0.978137 -1.164434 0.056713
C 1.319528 -0.335166 0.000600
C -0.457975 -2.574307 0.176603
C 0.853158 -2.745877 -0.600334
C 1.817390 -1.636045 -0.282870
C -0.773247 1.647106 2.205132
C -2.454683 -1.062737 0.064618
C 2.233498 0.675924 0.326677
C 3.186359 -1.891854 -0.280659
C 3.612041 0.439811 0.344886
C 4.071892 -0.842569 0.032051
C -3.167969 -1.043151 -1.144635
C -3.148134 -1.013075 1.283986
C -4.562945 -0.970286 -1.130503
C -4.543574 -0.940223 1.290496
C -5.252829 -0.918064 0.085356
C 6.400793 -0.245120 0.307955
H -1.817113 1.235795 -0.325104
H -0.450058 1.205988 -2.403626
H 0.939913 1.907788 -1.566739
H -1.813940 3.253390 -1.964237
H -0.292591 3.713923 -2.737325
H -0.582496 4.207309 1.554311
H -2.014412 3.569800 0.697327
H 0.715687 4.322078 -0.545886
H -0.813297 5.195840 -0.750646
H -0.299597 -2.808626 1.250912
H -1.208291 -3.304016 -0.186709
H 0.652412 -2.740283 -1.693778
H 1.294405 -3.737544 -0.380240
H -0.249702 0.691574 2.382609
H -1.855691 1.464146 2.274190
H -0.479372 2.329919 3.016715
H 1.869842 1.680102 0.582621
H 3.587297 -2.875863 -0.506210
H 4.290719 1.244044 0.601225
H -2.629456 -1.084607 -2.089590
H -2.595500 -1.033935 2.221210
H -5.114394 -0.954888 -2.069081
H -5.079760 -0.902065 2.237158
H -6.339054 -0.861759 0.093254
H 6.276522 0.111786 1.334326
H 6.364911 0.574516 -0.415279
H 7.326896 -0.824253 0.201637


%chk=000202282-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202282

0 1
O 5.478015 -1.287045 0.086706
N -0.209017 2.298511 0.827036
C -0.661638 1.334855 -0.239570
C -0.259983 1.877988 -1.639659
C -0.148006 -0.096107 -0.019648
C -0.839448 3.287847 -1.886282
C -0.816134 3.639918 0.618047
C -0.419719 4.238711 -0.744688
C -1.026327 -1.156186 0.131449
C 1.321603 -0.354855 0.039539
C -0.459201 -2.552846 0.419794
C 0.815056 -2.799501 -0.409889
C 1.817593 -1.687658 -0.158297
C -0.495753 1.800544 2.192329
C -2.516432 -1.071194 0.069698
C 2.273368 0.676545 0.264203
C 3.197416 -1.946431 -0.136720
C 3.661089 0.420374 0.289736
C 4.126933 -0.899724 0.083690
C -3.204226 -0.506281 -1.042318
C -3.300893 -1.643360 1.112454
C -4.615240 -0.492127 -1.098039
C -4.711206 -1.619727 1.064516
C -5.377662 -1.041849 -0.041635
C 6.476328 -0.241313 0.316548
H -1.777024 1.297123 -0.206807
H -0.617792 1.168997 -2.410748
H 0.842452 1.906945 -1.716488
H -1.947585 3.232296 -1.925563
H -0.500770 3.676932 -2.865518
H -0.473928 4.299065 1.438289
H -1.936450 3.586167 0.680780
H 0.677387 4.388084 -0.767293
H -0.896299 5.230947 -0.863594
H -0.211569 -2.642830 1.500161
H -1.217428 -3.323744 0.195625
H 0.543341 -2.818528 -1.486860
H 1.254572 -3.784704 -0.169115
H 0.049741 0.859905 2.375372
H -1.583442 1.610223 2.368512
H -0.151961 2.548075 2.929953
H 1.894818 1.687587 0.453663
H 3.580107 -2.961663 -0.286925
H 4.355383 1.245533 0.475601
H -2.625386 -0.108423 -1.883360
H -2.797244 -2.093774 1.976104
H -5.118572 -0.058963 -1.970099
H -5.290117 -2.052671 1.888452
H -6.472495 -1.028982 -0.083478
H 6.346691 0.228453 1.311208
H 6.430764 0.538869 -0.468270
H 7.447890 -0.755411 0.273000


