%chk=000202603.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202603

1 1
O 1.784757 0.344108 -0.095776
O 1.723230 -1.901814 0.228812
N -2.275424 0.911782 -0.065242
C -3.083971 -0.237633 -0.679926
C -0.788042 0.729165 -0.389772
C -2.623341 -1.607455 -0.170952
C -2.473265 0.957250 1.433855
C -2.753083 2.219280 -0.661412
C -0.322363 -0.669787 -0.119578
C -1.141745 -1.728451 -0.042869
C 1.155295 -0.856013 0.029838
C 3.284572 0.368432 0.018856
C 3.625892 1.692968 -0.630382
C 3.635049 0.270583 1.486963
H -2.970229 -0.193710 -1.791082
H -4.167551 -0.088659 -0.464941
H -0.175859 1.463572 0.198552
H -0.599446 0.974520 -1.466048
H -3.008133 -2.396049 -0.867119
H -3.101538 -1.859234 0.805662
H -2.035094 0.065852 1.926650
H -1.982254 1.840811 1.884732
H -3.543196 0.997326 1.707533
H -2.660435 2.230064 -1.764347
H -3.814926 2.418611 -0.419986
H -2.170458 3.080625 -0.279552
H -0.750491 -2.742563 0.138379
H 3.652116 -0.506777 -0.563094
H 3.262660 1.747391 -1.664994
H 3.200408 2.546647 -0.087848
H 4.715960 1.842706 -0.660992
H 3.133284 1.034490 2.092403
H 4.716629 0.395310 1.646512
H 3.368294 -0.713148 1.902767


%chk=000202603-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202603

1 1
O 1.805406 0.394061 -0.065857
O 1.705516 -1.933797 0.204891
N -2.350801 0.913270 -0.038173
C -3.093902 -0.246872 -0.741209
C -0.835985 0.785233 -0.316830
C -2.652728 -1.617684 -0.206788
C -2.608628 0.888405 1.467440
C -2.848162 2.238753 -0.606765
C -0.333661 -0.629564 -0.100985
C -1.155404 -1.712989 -0.051299
C 1.149177 -0.825204 0.037532
C 3.331745 0.375371 0.034940
C 3.800969 1.611960 -0.728900
C 3.719805 0.355473 1.517726
H -2.853318 -0.151067 -1.813866
H -4.174080 -0.073886 -0.601061
H -0.314421 1.496026 0.345316
H -0.667492 1.118815 -1.356906
H -3.004476 -2.387406 -0.920081
H -3.154366 -1.862987 0.750728
H -2.114557 0.012705 1.910333
H -2.193740 1.807064 1.909661
H -3.694132 0.845554 1.645840
H -2.762540 2.217757 -1.703849
H -3.900128 2.385329 -0.317279
H -2.232861 3.056920 -0.201660
H -0.703632 -2.697592 0.120019
H 3.655889 -0.558237 -0.460112
H 3.451922 1.593308 -1.775259
H 3.441703 2.538492 -0.247745
H 4.904964 1.638549 -0.738690
H 3.336974 1.250739 2.038652
H 4.820918 0.354393 1.606770
H 3.341330 -0.550693 2.019068


