%chk=000299879.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299879

0 1
O 2.531217 0.827644 1.224876
O -2.532511 1.611688 -0.615057
O 1.887430 1.679942 -0.780595
O 0.504307 -3.412400 1.102918
O -1.963251 0.793839 1.458530
N -0.626226 0.429698 -0.427577
N -1.176550 -2.653809 -0.217810
C 0.541546 -0.065092 0.332743
C 0.986416 -1.437254 -0.188061
C 1.707161 0.925115 0.144724
C 3.765712 1.623382 1.231592
C 0.105230 -2.569680 0.319525
C 4.829676 0.894200 0.465001
C -1.722409 0.945127 0.279676
C -3.866072 1.987511 -0.129750
C -4.787624 0.806357 -0.221106
C 5.721080 0.041280 1.130710
C 4.929691 1.065085 -0.924197
C -5.597777 0.627026 -1.351024
C -4.837097 -0.122267 0.829785
C 6.715436 -0.627112 0.410193
C 5.924683 0.394936 -1.639309
C 6.819558 -0.449542 -0.972991
C -6.461023 -0.470389 -1.422774
C -5.700311 -1.217423 0.752824
C -6.514481 -1.391341 -0.371736
H 0.284386 -0.134548 1.434706
H 2.028935 -1.646928 0.160672
H 1.039788 -1.457898 -1.296614
H -0.444146 0.776143 -1.377262
H 3.546184 2.626505 0.820468
H 3.962687 1.688776 2.318841
H -4.112350 2.804139 -0.835387
H -3.773749 2.384508 0.899545
H 5.638400 -0.107416 2.206702
H 4.219959 1.714828 -1.443455
H -5.555211 1.337901 -2.174956
H -4.190376 0.010857 1.702925
H -1.818890 -3.339235 0.154608
H -1.595302 -1.895860 -0.732919
H 7.407770 -1.289309 0.928150
H 6.002758 0.530043 -2.717104
H 7.595623 -0.970364 -1.531911
H -7.092227 -0.607420 -2.299410
H -5.740540 -1.934841 1.571488
H -7.189809 -2.243799 -0.428398


%chk=000299879-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299879

0 1
O 2.734363 0.968692 1.326309
O -2.655473 1.696636 -0.426932
O 1.893387 1.912044 -0.641098
O 0.075275 -3.145521 1.451655
O -2.078195 0.815440 1.688374
N -0.586017 0.806631 -0.131796
N -1.335339 -2.166328 -0.112499
C 0.551767 0.261886 0.615101
C 0.920893 -1.204830 0.206653
C 1.775328 1.152127 0.351431
C 4.060179 1.683775 1.126268
C -0.143799 -2.249861 0.584112
C 5.012615 0.840399 0.312115
C -1.788162 1.085019 0.494796
C -4.071434 1.872601 0.054038
C -4.894811 0.631680 -0.218893
C 5.827414 -0.132314 0.946246
C 5.101926 1.010778 -1.093850
C -5.591366 0.488626 -1.446206
C -4.968794 -0.409316 0.744177
C 6.715176 -0.926644 0.188089
C 5.991846 0.218363 -1.852354
C 6.799577 -0.751395 -1.213294
C -6.345132 -0.675979 -1.713434
C -5.722360 -1.574521 0.477501
C -6.411530 -1.710885 -0.751123
H 0.301513 0.279905 1.690006
H 1.844222 -1.491524 0.734885
H 1.115518 -1.233977 -0.882681
H -0.390228 1.257128 -1.031471
H 3.844959 2.652910 0.645758
H 4.404283 1.826334 2.161790
H -4.420419 2.739477 -0.528131
H -4.035891 2.115005 1.129707
H 5.761583 -0.269244 2.032517
H 4.464633 1.755108 -1.584505
H -5.541158 1.290775 -2.192931
H -4.424955 -0.301914 1.689314
H -2.090170 -2.807363 0.132461
H -1.530135 -1.384599 -0.737820
H 7.340117 -1.676215 0.685666
H 6.056860 0.357030 -2.937153
H 7.490558 -1.365199 -1.801930
H -6.882164 -0.775133 -2.663311
H -5.778958 -2.370176 1.228854
H -6.999799 -2.612829 -0.954613


