%chk=000297820.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297820

0 1
O 4.657325 3.099731 -1.188415
O 3.666193 1.864220 -2.772640
O 4.740396 -0.667238 0.979191
O -2.220604 -0.608959 -0.336072
O 1.380413 -2.133392 -1.623258
O -1.265143 -1.396428 1.595979
N 3.258292 -0.094721 -0.670722
N 2.521268 -3.008354 0.147871
N -1.104542 -2.570285 -0.431675
C 1.907655 1.919294 -0.040734
C 3.300343 1.345932 -0.362211
C 1.366389 1.365281 1.282084
C 0.067774 2.068737 1.698815
C 3.851218 2.065846 -1.599048
C -0.496415 1.470906 2.984463
C 3.993106 -1.006068 0.079958
C 3.810968 -2.478826 -0.329009
C 1.358030 -2.761041 -0.574477
C 0.068626 -3.353908 -0.000356
C -4.002364 0.940642 -0.422624
C -2.847845 0.487739 0.419460
C -1.480649 -1.500173 0.405264
C -3.878681 1.003019 -1.817990
C -5.202345 1.324892 0.193906
C -4.952152 1.450002 -2.592979
C -6.268728 1.779282 -0.586573
C -6.145878 1.841861 -1.978745
H 1.979207 3.026013 0.015380
H 1.197510 1.702256 -0.864237
H 4.004488 1.522457 0.509122
H 1.189928 0.274703 1.195288
H 2.124663 1.478996 2.083126
H 0.247982 3.152920 1.832327
H -0.691676 1.980782 0.886702
H 2.597458 -0.402813 -1.399831
H 0.221996 1.529830 3.809891
H -1.404392 1.990780 3.305482
H -0.751296 0.406130 2.854302
H 4.647352 -3.072299 0.111632
H 3.887642 -2.588391 -1.439999
H 2.511902 -3.395064 1.087035
H 5.049436 3.612498 -1.945541
H 0.084963 -3.421108 1.116714
H -0.054019 -4.400426 -0.377904
H -1.162876 -2.411885 -1.447578
H -2.056184 1.269008 0.522751
H -3.137238 0.118921 1.421219
H -2.947338 0.689488 -2.291089
H -5.308342 1.270509 1.275882
H -4.856990 1.493590 -3.677023
H -7.199300 2.081726 -0.108583
H -6.979927 2.193589 -2.583529


%chk=000297820-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297820

0 1
O 3.436554 3.482212 -1.947209
O 3.314233 1.491752 -3.138882
O 4.617232 -0.149600 0.937206
O -2.748670 -1.579453 -0.063826
O 1.394031 -2.254109 -1.653600
O -1.072278 -1.698600 1.605138
N 3.003176 0.039682 -0.749795
N 2.557907 -2.831063 0.273657
N -1.043159 -3.055814 -0.306166
C 1.522396 2.007351 -0.189440
C 2.913442 1.498596 -0.681603
C 1.166637 1.494957 1.223311
C -0.145130 2.112203 1.759200
C 3.243447 2.098056 -2.049474
C -0.544866 1.538055 3.136301
C 3.855887 -0.672329 0.066470
C 3.817716 -2.201516 -0.167399
C 1.436033 -2.839505 -0.523610
C 0.243474 -3.661114 0.012144
C -3.890918 0.580646 -0.264140
C -3.451515 -0.505042 0.694475
C -1.569186 -2.077506 0.509940
C -2.988602 1.117706 -1.217175
C -5.204700 1.103404 -0.187410
C -3.395514 2.160819 -2.076227
C -5.610119 2.156470 -1.039160
C -4.706197 2.687578 -1.986672
H 1.548159 3.113356 -0.196617
H 0.740234 1.694495 -0.911965
H 3.683221 1.831096 0.040373
H 1.067733 0.391974 1.211270
H 1.997104 1.729846 1.919917
H -0.033410 3.213902 1.826631
H -0.961736 1.928476 1.030534
H 2.437460 -0.479815 -1.438548
H 0.246347 1.725021 3.886999
H -1.477903 1.999403 3.510811
H -0.699416 0.445374 3.069230
H 4.655160 -2.641322 0.395351
H 3.943703 -2.414846 -1.244135
H 2.495198 -3.167990 1.236186
H 3.631119 3.854859 -2.849601
H 0.312466 -3.783303 1.107148
H 0.290915 -4.664677 -0.449234
H -1.447611 -3.173461 -1.235366
H -2.751540 -0.129270 1.464845
H -4.316807 -0.971852 1.196936
H -1.977372 0.702285 -1.297776
H -5.914393 0.686265 0.538009
H -2.693272 2.563924 -2.814504
H -6.628914 2.553518 -0.969044
H -5.020159 3.499105 -2.652501


