%chk=000299792.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299792

0 1
O 1.894836 3.288416 0.490890
O -6.531622 -0.098034 -0.170684
O -5.270564 -0.846136 -1.862503
O 4.376666 -2.146836 -1.182696
O 2.502042 -2.773082 -0.298851
N 1.408184 1.053627 0.526904
N 3.310532 -1.917304 -0.638107
C -1.784496 -0.282939 0.733052
C -2.917063 -0.754872 -0.145976
C 0.086321 1.345879 1.172953
C -1.038661 0.772742 0.370167
C -4.215001 -0.021315 0.206064
C -1.578852 -1.069114 1.985219
C 1.742871 -0.236884 0.243674
C 2.297685 2.186905 0.190271
C 2.963893 -0.531384 -0.363166
C 3.540634 1.810709 -0.449446
C 3.870529 0.520504 -0.717586
C -5.313389 -0.385061 -0.748327
H -3.060301 -1.852435 -0.049972
H -2.677645 -0.600530 -1.222967
H -0.023050 2.461963 1.249549
H 0.106478 0.959608 2.219744
H -1.229249 1.299228 -0.568201
H -4.064443 1.082871 0.176337
H -4.528241 -0.238082 1.251655
H -0.876492 -0.595436 2.685845
H -1.186791 -2.074299 1.762334
H -2.522400 -1.215315 2.532183
H 1.036658 -1.050234 0.501490
H 4.198828 2.644834 -0.705325
H 4.817177 0.247771 -1.202213
H -7.300372 -0.303262 -0.768012


%chk=000299792-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299792

0 1
O 2.206516 3.288424 0.827793
O -6.742171 -0.369098 -0.108731
O -5.337481 -1.263739 -1.728382
O 4.517314 -2.156854 -1.409694
O 2.379587 -2.760447 -0.854036
N 1.539759 1.059397 0.428736
N 3.337614 -1.890146 -0.946531
C -1.856313 -0.143191 0.721235
C -2.973386 -0.644263 -0.187052
C 0.187666 1.389603 1.005822
C -0.942483 0.750561 0.239354
C -4.380049 -0.246122 0.321029
C -1.857244 -0.698707 2.135337
C 1.817407 -0.204256 -0.003576
C 2.526427 2.138812 0.400632
C 3.079517 -0.524042 -0.500729
C 3.825696 1.757726 -0.139154
C 4.104951 0.474235 -0.572441
C -5.478318 -0.691405 -0.626482
H -2.927847 -1.749060 -0.261955
H -2.840335 -0.256640 -1.212313
H 0.132888 2.493022 0.975046
H 0.192669 1.098784 2.070888
H -1.037450 1.082816 -0.804547
H -4.459158 0.851841 0.441132
H -4.597252 -0.677414 1.315873
H -0.920385 -0.503411 2.682608
H -2.015900 -1.793670 2.116631
H -2.682107 -0.266652 2.734697
H 1.020819 -0.952042 0.042349
H 4.574798 2.552269 -0.177513
H 5.084534 0.197079 -0.971173
H -7.445583 -0.660906 -0.750554


