%chk=000148070.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000148070

0 1
O 1.225228 -0.928758 3.203624
O 1.566215 0.414100 0.771880
N 1.737024 -3.162156 0.319311
N -5.550464 -0.312863 0.698293
C 1.288137 -3.215857 -1.115604
C 0.933524 -2.284010 1.211681
C 1.928612 -1.497235 2.095572
C -0.182217 -3.669626 -1.247355
C 1.469196 -1.826701 -1.749251
C 2.203466 -4.239402 -1.819126
C 2.660764 -0.394487 1.312031
C 1.871510 1.493846 -0.011310
C 0.725583 2.135091 -0.561121
C 3.165647 1.964560 -0.272424
C 0.922662 3.267239 -1.369804
C 3.321796 3.091208 -1.082207
C 2.209958 3.741944 -1.628393
C -0.570992 1.643322 -0.303807
C -1.680127 1.211613 -0.081917
C -2.975648 0.704525 0.179339
C -3.168765 -0.283717 1.162847
C -4.088862 1.177127 -0.540060
C -4.468135 -0.760360 1.387971
C -5.351811 0.642091 -0.248240
H 1.779480 -4.106497 0.715403
H 0.309793 -1.564677 0.631251
H 0.236178 -2.846154 1.867320
H 2.667578 -2.172544 2.588645
H -0.875546 -2.935593 -0.824809
H -0.461843 -3.799875 -2.298083
H -0.363029 -4.623861 -0.745280
H 2.524373 -1.531925 -1.757880
H 0.927344 -1.048366 -1.192923
H 1.107574 -1.808216 -2.781075
H 2.034331 -5.260239 -1.464560
H 2.033905 -4.236544 -2.900529
H 3.261553 -4.003031 -1.652151
H 3.245145 -0.814254 0.473586
H 3.277233 0.240839 1.967890
H 0.637406 -0.199708 2.901360
H 4.038215 1.472183 0.145531
H 0.055132 3.773706 -1.796759
H 4.324945 3.467127 -1.289489
H 2.347669 4.619827 -2.256181
H -2.328563 -0.664434 1.737553
H -3.970153 1.940672 -1.304498
H -4.666727 -1.528270 2.145343
H -6.247592 0.979942 -0.783095


%chk=000148070-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148070

0 1
O 0.542704 -0.969870 2.811939
O 1.326724 0.516575 0.685025
N 2.010866 -3.149385 0.104088
N -5.865859 0.365496 1.021485
C 1.680536 -3.731744 -1.240948
C 0.944296 -2.449329 0.854387
C 1.572495 -1.507572 1.912172
C 0.463842 -4.702958 -1.184272
C 1.395174 -2.585066 -2.242577
C 2.941796 -4.504457 -1.698274
C 2.367583 -0.366414 1.260035
C 1.695069 1.668736 -0.005089
C 0.603940 2.480105 -0.463649
C 3.031886 2.045525 -0.263112
C 0.902320 3.667764 -1.187871
C 3.296115 3.231966 -0.983962
C 2.235416 4.043992 -1.448326
C -0.739466 2.086551 -0.184109
C -1.893907 1.717104 0.077418
C -3.215112 1.271364 0.389254
C -3.432257 0.114404 1.196718
C -4.369394 1.958954 -0.089815
C -4.753361 -0.288616 1.478425
C -5.649020 1.473878 0.248312
H 2.460283 -3.866506 0.693347
H 0.349533 -1.837731 0.153259
H 0.239034 -3.123484 1.389028
H 2.253758 -2.086148 2.563953
H -0.445626 -4.180854 -0.834627
H 0.246574 -5.124317 -2.183435
H 0.664160 -5.544700 -0.493893
H 2.243217 -1.877831 -2.261513
H 0.481771 -2.020609 -1.981440
H 1.251863 -2.994437 -3.259053
H 3.185052 -5.322643 -0.991943
H 2.783901 -4.955736 -2.693830
H 3.810194 -3.824128 -1.752325
H 3.017116 -0.774987 0.463412
H 2.952230 0.202391 2.008153
H 0.126134 -0.199566 2.340156
H 3.861585 1.425965 0.088412
H 0.070310 4.286858 -1.538494
H 4.334539 3.519210 -1.181694
H 2.447290 4.961280 -2.006356
H -2.583909 -0.452484 1.593725
H -4.260189 2.851970 -0.712391
H -4.944444 -1.172476 2.097388
H -6.550061 1.985561 -0.108594


