%chk=000188959.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188959

0 1
O 2.191444 -0.813223 -1.400568
O 1.263520 2.283674 -0.207605
O 3.881329 1.684013 -0.296816
O 4.364983 -1.818561 1.365941
O -4.367079 -1.815835 0.647379
N -0.050425 -0.666127 -0.734339
N -1.631484 1.208805 -0.128125
N -1.484713 -2.416028 -0.378929
N -3.825833 0.410854 0.557167
N -3.298260 2.733069 0.675518
C 1.629616 0.954460 0.164006
C 1.158582 0.116448 -1.066149
C 3.138990 0.627422 0.308142
C 3.314038 -0.694201 -0.482380
C 3.289847 -1.931934 0.430100
C -1.270697 -0.129374 -0.303870
C -0.247824 -2.091424 -0.765444
C -2.145114 -1.220710 -0.082021
C 1.731549 3.322350 0.683452
C -3.522244 -0.999478 0.398220
C -2.973919 1.387397 0.359608
H 1.099817 0.693127 1.109317
H 0.987460 0.738025 -1.983269
H 3.454691 0.517956 1.370642
H 4.197900 -0.671114 -1.154358
H 3.353470 -2.867904 -0.150494
H 2.381589 -1.967992 1.064689
H 4.840621 1.568856 -0.114694
H 0.540454 -2.754795 -1.089055
H -0.929513 1.955067 -0.156833
H 2.828228 3.369925 0.647581
H 1.361463 3.158218 1.697772
H 1.292589 4.222492 0.235369
H 5.190278 -2.192368 0.992026
H -3.071078 3.423248 -0.032140
H -4.259275 2.847960 1.009061


%chk=000188959-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188959

0 1
O 2.101330 -1.091409 -1.191487
O 1.040248 2.083199 0.236211
O 3.507344 1.729579 -0.958631
O 4.934354 -1.482197 1.262295
O -4.693701 -1.590993 0.332422
N -0.172212 -0.760952 -0.593975
N -1.633723 1.212002 -0.141369
N -1.756537 -2.403718 -0.410291
N -3.959472 0.643996 0.245320
N -3.258553 2.882023 0.266933
C 1.657000 0.765514 0.276731
C 1.091346 -0.074353 -0.901915
C 3.189702 0.705686 0.040476
C 3.373117 -0.734745 -0.493473
C 3.639620 -1.765166 0.624735
C -1.381476 -0.141054 -0.301483
C -0.465762 -2.152294 -0.656920
C -2.354838 -1.145818 -0.182074
C 1.593377 3.028788 1.220317
C -3.747195 -0.779380 0.150183
C -2.983725 1.529445 0.120573
H 1.424026 0.265531 1.241376
H 0.955606 0.586505 -1.781311
H 3.780493 0.850814 0.965460
H 4.179237 -0.779477 -1.250137
H 3.589428 -2.788270 0.205939
H 2.885852 -1.682740 1.426011
H 4.474082 1.687671 -1.170068
H 0.303318 -2.878685 -0.896372
H -0.843209 1.869745 -0.032402
H 2.639357 3.268414 0.962099
H 1.528945 2.616286 2.247210
H 0.976907 3.937556 1.146732
H 5.657058 -1.959097 0.784408
H -2.626395 3.605643 -0.066219
H -4.229949 3.114250 0.461596


