%chk=000202641.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202641

0 1
O -0.848888 -1.377929 -0.508198
O 4.356327 2.224009 1.064825
O 5.994342 -1.412113 -0.330677
O 6.412598 0.651442 0.499409
N -4.873528 -0.092331 0.030778
N -0.037438 0.625635 0.303548
C -5.841849 -1.106228 0.565950
C -5.424129 0.594523 -1.184622
C -7.162131 -0.414605 0.945174
C -6.736882 1.311556 -0.827992
C -7.763454 0.326770 -0.254990
C -3.544529 -0.716601 -0.260768
C -2.460494 0.319139 0.101963
C -1.082124 -0.269125 -0.080443
C 1.358647 0.374451 0.245739
C 2.210117 1.403442 0.678358
C 1.890834 -0.852667 -0.225771
C 3.598300 1.194689 0.635086
C 4.149395 -0.027497 0.165802
C 3.259360 -1.038957 -0.260528
C 5.592071 -0.189761 0.142537
C 7.431618 -1.638925 -0.379751
H -5.389624 -1.561905 1.473826
H -6.039742 -1.930697 -0.152361
H -5.594784 -0.105619 -2.031189
H -4.673931 1.339680 -1.525396
H -7.874555 -1.163791 1.335318
H -6.976818 0.302462 1.770200
H -6.531149 2.107909 -0.084831
H -7.140925 1.815556 -1.724406
H -8.075733 -0.395335 -1.032838
H -8.679705 0.865385 0.049811
H -3.391290 -1.631077 0.354733
H -3.419980 -1.040979 -1.316735
H -2.588312 1.231579 -0.517202
H -2.625177 0.656082 1.150006
H -0.304513 1.547400 0.665577
H 1.841620 2.357059 1.046903
H 1.215562 -1.648047 -0.559723
H 3.680410 -1.983290 -0.622837
H 5.372532 2.025642 1.015458
H 7.492556 -2.658056 -0.775589
H 7.895160 -0.906995 -1.048863
H 7.849934 -1.561384 0.628909


%chk=000202641-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202641

0 1
O -0.934609 -1.616073 0.467512
O 4.358178 2.384041 -0.361830
O 6.106306 -1.454556 0.167021
O 6.416549 0.820297 -0.203651
N -4.939701 -0.214133 0.103570
N -0.050971 0.532975 0.114868
C -5.924799 -1.300785 -0.148333
C -5.363789 1.054194 -0.545796
C -7.322936 -0.918617 0.378283
C -6.746095 1.509436 -0.035156
C -7.803815 0.405358 -0.257389
C -3.567814 -0.627315 -0.272332
C -2.489314 0.283765 0.353140
C -1.103678 -0.372550 0.310754
C 1.347203 0.292459 0.091076
C 2.186503 1.412486 -0.118772
C 1.909912 -1.009936 0.269944
C 3.587614 1.259059 -0.153684
C 4.167592 -0.046125 0.026452
C 3.301528 -1.154661 0.235410
C 5.625129 -0.170342 -0.014966
C 7.581407 -1.605634 0.130291
H -5.564701 -2.215922 0.357389
H -5.999551 -1.532107 -1.244775
H -5.404581 0.935456 -1.662853
H -4.614157 1.836715 -0.327042
H -8.033357 -1.739037 0.159950
H -7.269408 -0.803659 1.478160
H -6.668680 1.734708 1.046096
H -7.038880 2.442925 -0.553489
H -7.957143 0.256606 -1.346646
H -8.778836 0.709861 0.167641
H -3.392697 -1.648304 0.110901
H -3.427176 -0.666420 -1.383546
H -2.467839 1.280481 -0.127484
H -2.765833 0.437554 1.415505
H -0.327620 1.509117 -0.016657
H 1.778146 2.419484 -0.257906
H 1.249091 -1.862083 0.428097
H 3.750629 -2.142760 0.370982
H 5.339367 2.095018 -0.357742
H 7.753514 -2.677892 0.296600
H 7.972574 -1.284774 -0.849359
H 8.046434 -0.997813 0.923964


