%chk=000230952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230952

0 1
O -0.264581 -0.010565 1.485828
O -0.089296 -0.542413 -0.767276
O -2.831049 1.981945 0.753612
O -2.566812 1.537560 -1.344393
N -2.582345 1.228330 -0.168816
C 1.897267 -0.177007 0.532542
C 2.883677 -1.028135 -0.305603
C 0.484568 -0.782865 0.527299
C -2.349410 -0.258604 0.185325
C 1.855723 1.271553 0.005265
C 4.299891 -0.418148 -0.204286
C -1.652125 -0.349369 1.565090
C -1.464267 -0.924946 -0.890834
C -3.746571 -0.914154 0.259470
C 2.917904 -2.492805 0.143188
C 3.217613 1.830396 -0.257665
C 4.312099 1.071580 -0.368860
C -4.469451 -0.980758 -1.079480
H 2.241715 -0.157638 1.597864
H 2.551867 -0.983858 -1.373412
H 0.417711 -1.857934 0.777978
H 1.299933 1.903901 0.729083
H 1.257272 1.309909 -0.935093
H 4.953426 -0.887033 -0.966800
H 4.753596 -0.669453 0.777625
H -2.038160 0.411526 2.279687
H -1.758385 -1.361131 1.994460
H -1.547772 -2.024487 -0.839993
H -1.710761 -0.566619 -1.915033
H -4.371557 -0.361039 0.995282
H -3.642709 -1.938301 0.674504
H 1.978208 -3.008462 -0.079846
H 3.710508 -3.044416 -0.376992
H 3.109480 -2.589131 1.217301
H 3.254916 2.912833 -0.374110
H 5.290573 1.502607 -0.572180
H -4.488102 -0.009415 -1.596269
H -4.009139 -1.699537 -1.767408
H -5.515153 -1.287613 -0.945253


%chk=000230952-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230952

0 1
O -0.294576 0.260895 1.449438
O -0.056241 -0.576424 -0.793321
O -3.085735 1.985485 0.475062
O -2.413042 1.393612 -1.613948
N -2.612654 1.142320 -0.372627
C 1.932469 -0.095770 0.538406
C 2.861618 -0.962712 -0.364160
C 0.491714 -0.609289 0.565058
C -2.359781 -0.309637 0.152621
C 1.982252 1.394776 0.108712
C 4.326900 -0.478267 -0.197974
C -1.677136 -0.211402 1.541670
C -1.438843 -1.066706 -0.829608
C -3.761346 -0.970740 0.294289
C 2.764754 -2.479094 -0.082241
C 3.402841 1.872290 -0.111932
C 4.464381 1.032611 -0.230625
C -4.575996 -1.082279 -1.012443
H 2.301904 -0.173412 1.582944
H 2.554645 -0.782694 -1.413707
H 0.409604 -1.653394 0.953042
H 1.488182 2.015446 0.879260
H 1.384338 1.528817 -0.815384
H 4.947783 -0.925513 -1.001207
H 4.742956 -0.873929 0.755355
H -2.205457 0.508431 2.183567
H -1.707519 -1.224391 2.001843
H -1.472101 -2.144243 -0.552191
H -1.764155 -0.938946 -1.870650
H -4.333816 -0.393502 1.045081
H -3.601774 -1.981383 0.718193
H 1.786878 -2.893821 -0.386715
H 3.542740 -3.024796 -0.648450
H 2.919599 -2.700001 0.992430
H 3.559228 2.958554 -0.170713
H 5.474457 1.444448 -0.364633
H -4.765584 -0.093654 -1.465929
H -4.067700 -1.709467 -1.766000
H -5.555487 -1.545914 -0.800711


