%chk=000200586.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200586

0 1
O 4.273455 -0.687369 0.948416
N -2.947462 -0.793123 -0.043566
C -0.597378 -0.019633 0.096685
C -0.963901 -0.722391 1.438006
C -1.722037 -0.521737 -0.861719
C -2.427635 -1.196417 1.305911
C -0.671227 1.518452 0.267808
C 0.805471 -0.392497 -0.360874
C -3.853495 0.402601 0.010807
C -0.360275 2.292805 -1.019304
C 1.858427 -0.353996 0.572887
C 1.078688 -0.732717 -1.691331
C -5.168833 0.039855 0.699112
C -0.540947 3.796707 -0.828922
C 3.150035 -0.677381 0.149599
C 2.384251 -1.054730 -2.092006
C 3.435743 -1.035301 -1.184693
C 4.119533 -0.337774 2.344175
H -0.835275 -0.050511 2.299335
H -0.301452 -1.587243 1.618430
H -1.918349 0.186415 -1.686631
H -1.437460 -1.492927 -1.323761
H -2.486567 -2.305250 1.345544
H -3.057946 -0.813506 2.128937
H 0.028597 1.834723 1.064496
H -1.687473 1.788064 0.629801
H -3.379001 1.278663 0.512610
H -4.061888 0.708910 -1.038823
H -1.012873 1.937050 -1.842016
H 0.678006 2.078002 -1.345657
H 1.661920 -0.069991 1.600093
H 0.286387 -0.750877 -2.434698
H -5.595862 -0.875923 0.266680
H -5.037216 -0.143239 1.771006
H -5.906486 0.840202 0.583221
H -1.569194 4.050687 -0.548901
H 0.118987 4.186557 -0.045525
H -0.308271 4.341281 -1.751282
H 2.574256 -1.322925 -3.131903
H 4.453587 -1.282162 -1.471411
H 3.760821 0.690746 2.441166
H 5.149053 -0.431552 2.713834
H 3.457683 -1.050647 2.843863


%chk=000200586-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200586

0 1
O 4.218518 -1.185017 0.939213
N -2.819984 -0.654054 0.220404
C -0.546917 0.296213 0.137678
C -0.924515 -0.259448 1.556632
C -1.780976 -0.150390 -0.728088
C -2.461348 -0.205778 1.584337
C -0.468897 1.865515 0.232957
C 0.801230 -0.240287 -0.372299
C -4.209582 -0.414507 -0.210828
C -0.173237 2.634358 -1.074878
C 1.858031 -0.474389 0.549096
C 1.050579 -0.446540 -1.752289
C -5.239789 -1.139531 0.674419
C -0.141136 4.161970 -0.846886
C 3.123144 -0.918332 0.097015
C 2.318861 -0.890975 -2.196988
C 3.360788 -1.131376 -1.283026
C 4.030440 -0.993690 2.377486
H -0.470986 0.329068 2.375020
H -0.594970 -1.309862 1.650656
H -2.164008 0.710301 -1.324136
H -1.515613 -0.955776 -1.438105
H -2.888627 -0.878647 2.349289
H -2.822891 0.831774 1.808853
H 0.320984 2.120540 0.969832
H -1.426555 2.235246 0.654457
H -4.448528 0.683357 -0.235680
H -4.306811 -0.782209 -1.250836
H -0.941231 2.396556 -1.838428
H 0.795500 2.300281 -1.490681
H 1.680288 -0.316641 1.616928
H 0.261196 -0.258154 -2.486998
H -5.019548 -2.221277 0.707753
H -5.231136 -0.753389 1.709661
H -6.259739 -0.998829 0.272141
H -1.110182 4.529665 -0.458546
H 0.639637 4.436003 -0.112047
H 0.075063 4.704433 -1.785597
H 2.494669 -1.049843 -3.266929
H 4.347278 -1.478566 -1.604460
H 3.783859 0.059550 2.617412
H 4.996292 -1.259445 2.832110
H 3.237246 -1.657978 2.773775


