%chk=000214971.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214971

0 1
O -0.043825 -2.169783 0.154024
N 2.138044 -1.233295 0.024642
N 3.357265 -0.232440 1.689648
C 2.770084 -0.112984 -0.565969
C 1.176386 -2.140712 -0.602821
C 3.538949 0.494222 0.488107
C -3.232836 -0.494303 0.631519
C -3.055001 0.716236 -0.093459
C -0.992325 -1.161753 0.022137
C 2.524405 -1.234205 1.403949
C -2.172905 -1.444256 0.680197
C 2.779442 0.401397 -1.871484
C -1.810663 0.960624 -0.752957
C -0.787983 0.044282 -0.704749
C 4.316664 1.634868 0.227099
C -4.480978 -0.731819 1.295847
C 3.555390 1.530155 -2.097323
C -4.126203 1.664926 -0.140909
C 4.311206 2.138726 -1.065182
C -5.487708 0.196591 1.231257
C -5.309951 1.411583 0.503480
H 0.993285 -1.869152 -1.661615
H 1.502612 -3.203656 -0.492898
H 2.151829 -1.983100 2.092451
H -2.292669 -2.374609 1.230357
H 2.212003 -0.064113 -2.669898
H -1.682542 1.898088 -1.296589
H 0.162734 0.248990 -1.189041
H 4.897105 2.091638 1.027555
H -4.607109 -1.660627 1.849702
H -3.979378 2.589763 -0.697496
H 3.591340 1.966822 -3.095539
H 4.901301 3.023053 -1.302894
H -6.439176 0.024819 1.733695
H -6.129294 2.127227 0.473359


%chk=000214971-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214971

0 1
O -0.041508 -2.194998 0.249602
N 2.179110 -1.190160 0.071018
N 3.564489 -0.267523 1.652367
C 2.817102 -0.101767 -0.563578
C 1.205776 -2.115455 -0.504893
C 3.678278 0.460261 0.439778
C -3.328123 -0.519830 0.623736
C -3.112825 0.746862 -0.050117
C -1.018758 -1.173241 0.116707
C 2.676604 -1.231832 1.388774
C -2.258710 -1.465364 0.690441
C 2.744552 0.420891 -1.872485
C -1.825838 1.008420 -0.619430
C -0.787732 0.076722 -0.542158
C 4.478561 1.584276 0.137008
C -4.616338 -0.786092 1.200539
C 3.551347 1.545121 -2.153721
C -4.187256 1.694715 -0.118514
C 4.403160 2.119348 -1.165544
C -5.642836 0.156278 1.116739
C -5.428678 1.408061 0.452383
H 1.027649 -1.827986 -1.557391
H 1.586780 -3.148690 -0.457134
H 2.327420 -1.975340 2.102998
H -2.401291 -2.430063 1.188246
H 2.111383 -0.017385 -2.652120
H -1.649978 1.970011 -1.115898
H 0.191925 0.330484 -0.954887
H 5.133847 2.014510 0.900259
H -4.782291 -1.742478 1.710424
H -4.018059 2.651771 -0.626669
H 3.524614 1.983168 -3.157504
H 5.012545 2.990527 -1.428683
H -6.621195 -0.057187 1.561427
H -6.244229 2.137166 0.396479


