%chk=000277980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277980

0 1
O 5.459675 -0.014337 3.238863
O 6.653195 1.012106 1.756038
N -3.517102 1.014888 -0.549840
N -1.618924 1.621319 -1.709992
N -2.766119 -1.276949 0.183291
N 0.744868 -0.333185 -2.005686
N -0.501507 -1.807769 -0.591568
N 5.687746 0.346284 2.095490
C -4.878410 1.139537 0.023037
C -4.883906 1.007766 1.562485
C -5.834820 0.037994 -0.485960
C -6.288728 0.487923 1.912471
C -6.885837 -0.121680 0.625878
C -2.632981 -0.062356 -0.454642
C -2.840926 2.011961 -1.327041
C -1.453653 0.331829 -1.185426
C -0.374754 -0.605810 -1.249530
C -1.679409 -2.075534 0.069840
C 1.932443 -1.213022 -2.004623
C 2.919732 -0.801817 -0.934022
C 2.701182 -1.190573 0.397058
C 4.045798 -0.034545 -1.269984
C 3.601859 -0.817308 1.392745
C 4.955042 0.343287 -0.282190
C 4.726450 -0.051768 1.044761
H -5.267178 2.148111 -0.274021
H -4.653318 1.961702 2.059239
H -4.114398 0.283062 1.898068
H -5.290743 -0.916672 -0.636566
H -6.285010 0.298027 -1.455272
H -6.928350 1.303106 2.291188
H -6.235255 -0.264262 2.718294
H -7.137370 -1.186171 0.772907
H -7.827565 0.384946 0.354813
H -3.302244 2.962522 -1.556762
H 0.870105 0.619709 -2.352056
H -1.727652 -3.060527 0.566022
H 2.390830 -1.174189 -3.020844
H 1.617472 -2.279214 -1.849162
H 1.816308 -1.785263 0.650492
H 4.217085 0.270373 -2.302370
H 3.444470 -1.112102 2.436300
H 5.839402 0.941501 -0.527821


%chk=000277980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277980

0 1
O 6.383236 0.601899 2.835582
O 7.728982 0.143695 1.051465
N -3.671612 1.003748 -0.307190
N -1.665868 1.811121 -1.102570
N -3.013767 -1.383529 0.047602
N 0.750253 -0.067958 -1.413191
N -0.667538 -1.785229 -0.573875
N 6.566429 0.249186 1.606118
C -5.088423 1.006967 0.116064
C -5.312487 0.566974 1.587571
C -5.992847 0.034648 -0.686626
C -6.837044 0.266090 1.652640
C -7.279636 -0.061197 0.179542
C -2.787998 -0.083240 -0.321181
C -2.941890 2.103438 -0.784302
C -1.560249 0.439688 -0.815160
C -0.473730 -0.475741 -0.939146
C -1.902262 -2.158216 -0.111096
C 1.880785 -0.978971 -1.617421
C 3.104135 -0.626382 -0.779008
C 2.961427 -0.235312 0.578604
C 4.404664 -0.718567 -1.337571
C 4.089676 0.051468 1.368287
C 5.547384 -0.436242 -0.564353
C 5.371719 -0.053586 0.782958
H -5.447387 2.046313 -0.020551
H -4.988989 1.334457 2.312063
H -4.725346 -0.350598 1.769188
H -5.485698 -0.944729 -0.744312
H -6.185237 0.386934 -1.714979
H -7.393164 1.141434 2.034803
H -7.044855 -0.571888 2.339899
H -7.739594 -1.061090 0.099402
H -8.035140 0.668961 -0.164239
H -3.393216 3.089492 -0.876182
H 0.839059 0.919105 -1.664620
H -2.004490 -3.211653 0.166340
H 2.158512 -1.011255 -2.689117
H 1.507787 -1.984293 -1.340745
H 1.958554 -0.158729 1.010912
H 4.524143 -1.012963 -2.386787
H 4.001805 0.349260 2.416367
H 6.557417 -0.500608 -0.977281


