%chk=000242014.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242014

0 1
O 0.073527 2.893884 -1.601642
O 2.985784 1.249983 -1.856412
O 2.255438 3.826824 1.905797
O 1.860478 -3.305913 -1.755137
O -3.822911 -1.359944 0.305354
O 1.100514 -4.404169 0.816300
O -5.168210 0.692161 1.074355
N 1.006167 2.037322 1.011616
N 2.981542 2.645344 0.002923
C 1.094391 1.197320 -0.220534
C -0.058397 1.509802 -1.237763
C 1.123845 -0.283915 0.106462
C 2.463600 1.641494 -0.844754
C -1.427132 1.334194 -0.623396
C 2.078080 2.968446 1.080486
C 1.509864 -1.182007 -0.902211
C 0.748289 -0.764546 1.365090
C -1.940150 0.025201 -0.488595
C -2.166513 2.435170 -0.204569
C 1.499792 -2.560952 -0.660674
C 0.741957 -2.140372 1.622219
C 1.107909 -3.037972 0.618164
C -3.189853 -0.161166 0.086063
C -3.437454 2.259488 0.371505
C -3.946835 0.975209 0.520137
C 2.060583 -4.731765 -1.569096
C -3.117138 -2.560198 -0.101225
H 0.063750 0.869976 -2.143285
H 0.075388 2.322372 1.321763
H 3.878961 3.105245 -0.124730
H 1.852504 -0.827645 -1.881000
H 0.460572 -0.077565 2.163043
H 0.493065 2.981253 -2.483745
H -1.349513 -0.823796 -0.828886
H -1.768325 3.444313 -0.339551
H 0.452748 -2.503772 2.606346
H -4.009572 3.126540 0.691711
H 0.906266 -4.625644 1.762649
H -5.645383 1.520572 1.338149
H 2.823397 -4.911630 -0.805631
H 2.402560 -5.038677 -2.564433
H 1.112931 -5.209486 -1.298450
H -2.974490 -2.568727 -1.185557
H -3.824147 -3.341609 0.208064
H -2.169078 -2.650441 0.437378


%chk=000242014-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242014

0 1
O 0.069641 2.784646 -1.856246
O 2.905149 1.260562 -1.933380
O 2.163947 3.757029 1.985580
O 1.573070 -3.539477 -1.740866
O -4.051363 -1.241348 0.277374
O 1.060278 -4.529167 0.918990
O -5.260448 0.960242 1.209476
N 0.924318 2.009435 0.938514
N 2.912614 2.555784 0.055119
C 1.046117 1.140462 -0.239240
C -0.102417 1.438551 -1.306599
C 1.101248 -0.355822 0.107829
C 2.404855 1.621660 -0.837579
C -1.480483 1.349923 -0.673437
C 1.993640 2.874643 1.114682
C 1.370991 -1.304859 -0.909385
C 0.868997 -0.811866 1.424757
C -2.108695 0.085197 -0.536880
C -2.126581 2.504841 -0.182382
C 1.379348 -2.690544 -0.641950
C 0.873444 -2.194044 1.706206
C 1.105536 -3.140811 0.684266
C -3.365075 -0.038102 0.094732
C -3.389525 2.390089 0.444094
C -4.012706 1.133830 0.594370
C 2.544421 -4.647988 -1.604987
C -3.411760 -2.458366 -0.232553
H 0.011338 0.676054 -2.102063
H 0.034505 2.164549 1.413396
H 3.791875 3.059499 -0.065430
H 1.616927 -0.990629 -1.928841
H 0.692082 -0.095428 2.231146
H 0.804982 2.767633 -2.521020
H -1.608366 -0.805665 -0.927538
H -1.662580 3.483400 -0.331083
H 0.679077 -2.540563 2.730203
H -3.897799 3.290341 0.814130
H 0.852531 -4.712571 1.868901
H -5.623008 1.835141 1.497992
H 3.546753 -4.249257 -1.357762
H 2.565612 -5.122028 -2.597699
H 2.221311 -5.366467 -0.835035
H -3.277805 -2.413304 -1.330841
H -4.106302 -3.271392 0.023539
H -2.430894 -2.633611 0.251800


