%chk=000299333.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299333

0 1
O 1.555477 0.746212 1.650928
O 2.228110 -1.515019 0.662463
N -3.969402 1.587394 2.324765
C -3.167282 -0.686489 2.216353
C -1.746920 -0.951005 1.796068
C -3.757247 0.527563 1.539933
C -4.089128 0.524771 0.131798
C -0.797146 0.089133 1.873549
C -4.674744 1.700963 -0.408107
C 0.519065 -0.157769 1.510236
C -1.358219 -2.220286 1.368059
C 0.907286 -1.451267 1.041935
C -0.029206 -2.478543 0.989341
C -3.853473 -0.588468 -0.730442
C -4.896975 2.820504 0.453711
C -5.025733 1.738846 -1.794536
C -4.536353 2.728441 1.777808
C 1.295062 2.114832 1.235929
C -4.197091 -0.528136 -2.058882
C -4.792295 0.649519 -2.596361
C 2.760049 -2.830837 0.313393
C 1.312245 2.249410 -0.262637
C 4.219770 -2.596077 0.033703
C 0.697836 3.357019 -0.864247
C 1.962168 1.292571 -1.054093
C 4.933977 -3.551710 -0.704680
C 4.867992 -1.450496 0.514493
C 0.739749 3.505214 -2.253491
C 1.997710 1.444396 -2.442134
C 6.294860 -3.357953 -0.955018
C 6.228025 -1.261111 0.254977
C 1.389096 2.551016 -3.043632
C 6.943212 -2.213882 -0.477264
H -3.821797 -1.564219 2.031150
H -3.186065 -0.544798 3.326879
H -1.099307 1.075193 2.228188
H -2.080522 -3.033032 1.322866
H 0.241671 -3.473663 0.650465
H -3.385100 -1.483893 -0.319903
H -5.345356 3.724495 0.050101
H -5.476169 2.645281 -2.195162
H -4.677439 3.550344 2.487666
H 0.357354 2.476864 1.691959
H 2.162370 2.631239 1.698985
H -4.016113 -1.373150 -2.720979
H 2.616600 -3.510753 1.174226
H 2.214425 -3.202068 -0.572845
H -5.054274 0.667941 -3.654129
H 0.186845 4.100713 -0.256876
H 2.429662 0.423872 -0.574127
H 4.436026 -4.441539 -1.082814
H 4.299900 -0.708984 1.084746
H 0.263257 4.364848 -2.720660
H 2.501872 0.698888 -3.054763
H 6.851318 -4.099654 -1.525387
H 6.730027 -0.368743 0.625984
H 1.419419 2.668789 -4.124577
H 8.002721 -2.065729 -0.676011


%chk=000299333-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299333

0 1
O 1.909978 0.779566 1.080551
O 2.583312 -1.740848 0.704755
N -3.571929 1.882456 1.825378
C -2.896346 -0.452842 2.006450
C -1.462676 -0.834657 1.629027
C -3.482481 0.691380 1.188501
C -3.919278 0.510525 -0.181511
C -0.475402 0.176960 1.495050
C -4.494413 1.647403 -0.870101
C 0.861519 -0.146145 1.193796
C -1.085481 -2.180612 1.448978
C 1.234656 -1.515937 1.010072
C 0.254421 -2.521436 1.141117
C -3.812573 -0.736750 -0.879569
C -4.582761 2.890940 -0.163126
C -4.951770 1.496061 -2.219582
C -4.113290 2.961597 1.146621
C 1.582994 2.221278 1.162936
C -4.264784 -0.856917 -2.196225
C -4.840870 0.265899 -2.870596
C 3.017663 -3.130297 0.550180
C 0.921198 2.754501 -0.098313
C 4.511485 -3.141479 0.272088
C -0.223383 3.583825 -0.023338
C 1.473488 2.449818 -1.368747
C 5.133590 -4.362213 -0.092246
C 5.295913 -1.969463 0.387513
C -0.804468 4.112329 -1.199123
C 0.891787 2.972595 -2.543375
C 6.524084 -4.413856 -0.331966
C 6.688098 -2.022523 0.144205
C -0.246768 3.809943 -2.461678
C 7.307469 -3.241579 -0.213860
H -3.542567 -1.347639 1.930722
H -2.923486 -0.117721 3.059411
H -0.778928 1.219214 1.621806
H -1.831593 -2.977263 1.555495
H 0.519751 -3.573832 1.004862
H -3.355548 -1.596467 -0.381039
H -5.016553 3.771466 -0.649987
H -5.388486 2.361071 -2.732687
H -4.161124 3.894423 1.719260
H 0.970336 2.430478 2.061846
H 2.578017 2.676702 1.308859
H -4.175640 -1.813939 -2.721824
H 2.791628 -3.694442 1.481413
H 2.462528 -3.610393 -0.284040
H -5.191031 0.154686 -3.902845
H -0.670142 3.812180 0.953128
H 2.345893 1.788896 -1.427375
H 4.532576 -5.276030 -0.189960
H 4.804563 -1.031441 0.660276
H -1.695421 4.746313 -1.128103
H 1.323199 2.728439 -3.520720
H 6.994143 -5.363211 -0.612630
H 7.288466 -1.109985 0.234602
H -0.698314 4.215229 -3.374277
H 8.386545 -3.279261 -0.401156


