%chk=000195686.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195686

2 1
O -2.432594 3.029013 0.426792
O -5.770248 -1.623131 -2.159227
O -4.466124 -2.711921 -0.803177
N -0.468496 0.491372 1.436860
N 6.196591 -0.666020 -0.665810
N -4.912803 -1.698151 -1.309543
C -1.899077 0.736917 1.863367
C -2.798850 0.723710 0.674245
C 2.164035 0.043363 0.596964
C 0.139563 -0.715723 1.697606
C 0.212059 1.474696 0.755807
C 3.560614 -0.198576 0.156598
C 1.452860 -0.953655 1.284653
C 1.528919 1.267035 0.335275
C -3.123476 1.927589 0.000286
C -3.414905 -0.456701 0.236761
C 4.630244 0.492191 0.750653
C 3.841045 -1.126211 -0.858495
C -4.310061 -0.419149 -0.835332
C -4.052883 1.974431 -1.049028
C 5.940271 0.247936 0.332842
C 5.161713 -1.348766 -1.261200
C -4.656635 0.792097 -1.467217
C 7.592788 -0.906472 -1.089522
H -1.948545 1.730217 2.391841
H -2.203116 -0.027603 2.621550
H -0.434600 -1.492321 2.241460
H -0.325172 2.431135 0.550257
H 1.913643 -1.926866 1.512183
H 2.047173 2.072689 -0.205512
H -3.209828 -1.418360 0.727587
H 4.456230 1.225925 1.553537
H 3.033468 -1.687029 -1.355428
H -4.313298 2.920888 -1.531128
H 6.795954 0.781927 0.795178
H 5.394988 -2.078073 -2.064076
H -5.396060 0.788951 -2.285566
H 7.674611 -1.653200 -1.908477
H 8.076147 0.024766 -1.463715
H 8.216943 -1.290381 -0.250201
H -2.797889 3.885764 0.051053


%chk=000195686-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195686

2 1
O -2.353460 3.022027 0.501828
O -6.011908 -1.420402 -2.294724
O -4.863248 -2.672291 -0.763559
N -0.462509 0.382437 1.423337
N 6.291299 -0.625809 -0.653119
N -5.165597 -1.557574 -1.338053
C -1.917470 0.601004 1.844943
C -2.853901 0.680664 0.656924
C 2.201431 -0.011945 0.587323
C 0.082282 -0.877781 1.453120
C 0.277693 1.454523 0.982204
C 3.613248 -0.221970 0.156700
C 1.402215 -1.098257 1.039316
C 1.604180 1.279079 0.565450
C -3.104501 1.934991 0.027379
C -3.546011 -0.459344 0.199847
C 4.610063 0.771020 0.373745
C 4.019273 -1.424162 -0.484669
C -4.462558 -0.333443 -0.860289
C -4.047033 2.052608 -1.019723
C 5.930475 0.549548 -0.033254
C 5.352227 -1.603504 -0.879772
C -4.734306 0.909854 -1.470004
C 7.719299 -0.823031 -1.073354
H -1.933631 1.538434 2.424542
H -2.181816 -0.237554 2.508282
H -0.555079 -1.685340 1.819118
H -0.243158 2.416356 0.957672
H 1.798960 -2.114081 1.113574
H 2.145508 2.156653 0.202498
H -3.417690 -1.444357 0.661426
H 4.384453 1.709982 0.885727
H 3.308841 -2.222597 -0.713617
H -4.244947 3.024808 -1.485132
H 6.722396 1.284807 0.127069
H 5.692015 -2.511675 -1.381546
H -5.468339 0.965280 -2.278746
H 7.828107 -1.801015 -1.562562
H 8.005561 -0.029266 -1.781665
H 8.370578 -0.786424 -0.185363
H -2.697740 3.892050 0.177830


