%chk=000279844.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279844

0 1
O 4.192936 1.742611 -0.484878
O 3.498151 -3.091452 -1.762067
O 5.364461 2.089235 1.419785
O 1.797653 0.029641 3.146681
O 2.112586 -1.345280 -1.388309
N 2.400400 0.270170 0.969062
N -4.045947 0.440357 0.470071
N -8.615017 -0.453781 0.482432
C 3.828714 0.176618 1.292327
C 4.501423 -1.089377 0.722841
C 4.493991 -1.203925 -0.802987
C 4.558835 1.437076 0.803947
C 1.436014 0.136929 1.981960
C 0.016842 0.186256 1.553073
C 3.225170 -1.823052 -1.321626
C -2.710815 0.309124 0.889117
C -0.915270 0.713555 2.464707
C -0.429331 -0.297351 0.311488
C -2.266818 0.781520 2.145838
C -1.775740 -0.245013 -0.023424
C -5.125095 0.667362 1.470838
C 4.760117 2.945429 -1.097973
C -6.463383 0.629422 0.784502
C 2.408654 -3.882911 -2.338870
C 6.178821 2.674347 -1.552048
C -6.819204 1.612930 -0.150807
C -7.393512 -0.389745 1.070209
C 2.130788 -3.420898 -3.753228
C -8.072738 1.554858 -0.762151
C -8.944320 0.506942 -0.419142
H 3.939094 0.160753 2.427247
H 4.013988 -1.979109 1.178503
H 5.553268 -1.119907 1.081402
H 5.371033 -1.801122 -1.138887
H 4.610262 -0.195229 -1.275652
H 2.154915 0.295373 -0.026695
H -0.562733 1.067969 3.439184
H 0.283139 -0.733539 -0.400081
H -2.963669 1.204512 2.861991
H -2.105749 -0.620236 -0.988005
H -4.332548 -0.123974 -0.329916
H -5.076128 -0.077237 2.300428
H -4.966121 1.670661 1.939417
H 4.698337 3.771732 -0.367096
H 4.053363 3.104514 -1.932766
H 1.526904 -3.796556 -1.679750
H 2.842890 -4.898383 -2.286725
H 6.842787 2.499923 -0.690849
H 6.240840 1.791257 -2.198331
H 6.588445 3.525473 -2.109980
H -6.116752 2.411594 -0.397309
H -7.168214 -1.185068 1.791201
H 1.420943 -4.085753 -4.259973
H 3.047398 -3.390215 -4.356387
H 1.699900 -2.408340 -3.764473
H -8.372398 2.305863 -1.489834
H -9.939459 0.420446 -0.871533


%chk=000279844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279844

0 1
O 3.785494 2.156625 0.171166
O 4.011506 -3.513434 -1.840532
O 5.803138 0.995079 0.110101
O 1.894800 0.968201 3.018321
O 2.553500 -1.843317 -1.161013
N 2.423239 -0.066207 1.008000
N -4.116914 0.140077 0.715700
N -8.895904 0.338215 0.664297
C 3.855821 -0.006481 1.272998
C 4.569472 -1.383450 1.165493
C 4.870874 -1.950811 -0.247955
C 4.593450 1.068062 0.449116
C 1.510231 0.435936 1.920827
C 0.059191 0.317509 1.564398
C 3.687786 -2.391622 -1.089505
C -2.756260 0.193148 1.027085
C -0.883952 0.894221 2.452137
C -0.432877 -0.341129 0.402063
C -2.265612 0.836468 2.202988
C -1.809772 -0.402741 0.137854
C -5.181953 0.665963 1.577895
C 4.419638 3.299926 -0.559370
C -6.487183 0.809419 0.810738
C 2.970940 -4.025487 -2.791680
C 4.314075 3.094650 -2.072847
C -6.553658 1.545319 -0.400459
C -7.686509 0.227234 1.290718
C 3.049543 -3.285324 -4.129038
C -7.792338 1.669782 -1.064904
C -8.933731 1.054132 -0.497522
H 3.929843 0.337539 2.329360
H 3.977575 -2.107555 1.754644
H 5.551463 -1.281859 1.661722
H 5.552128 -2.813983 -0.158191
H 5.426514 -1.182444 -0.822162
H 2.143508 -0.533343 0.137351
H -0.495780 1.384510 3.351315
H 0.246901 -0.820803 -0.311462
H -2.957828 1.278057 2.926570
H -2.168155 -0.910579 -0.766845
H -4.406116 -0.471778 -0.048123
H -5.344051 0.026940 2.474208
H -4.869010 1.661841 1.951708
H 5.471766 3.385102 -0.235232
H 3.840607 4.172137 -0.217412
H 1.979634 -3.908014 -2.320298
H 3.223035 -5.092893 -2.891712
H 4.911370 2.224576 -2.393581
H 3.263983 2.940970 -2.375371
H 4.698464 3.989112 -2.597559
H -5.647487 2.009390 -0.806101
H -7.684809 -0.357541 2.219525
H 2.338026 -3.736863 -4.844957
H 4.062845 -3.356710 -4.560195
H 2.785574 -2.221441 -4.007346
H -7.879706 2.233510 -1.999067
H -9.914228 1.129155 -0.981364


