%chk=000283301.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283301

0 1
O -0.780822 3.123013 -0.267154
O 1.981324 2.897729 0.925609
O 3.815811 -2.163103 -0.033793
O 2.164266 2.921625 -1.339608
O 2.192543 -3.731871 0.112659
N -2.484518 1.660169 -0.119775
C -0.684561 -0.525758 -0.025419
C -0.174835 0.786568 -0.129114
C -2.127409 -0.751137 0.030696
C -3.009874 0.355446 -0.018445
C 1.220119 0.994777 -0.185851
C 0.224393 -1.608553 0.023374
C -1.096972 1.951016 -0.179678
C 1.595422 -1.383350 -0.030627
C 2.106305 -0.076198 -0.135961
C -2.691025 -2.043064 0.132590
C -4.412966 0.172255 0.033004
C -4.065060 -2.223584 0.183154
C -4.927002 -1.111101 0.132955
C 1.806031 2.370344 -0.330063
C 2.501986 -2.565921 0.026099
C 2.443863 4.276583 0.986421
C 4.817267 -3.217562 0.008001
H -0.150718 -2.636727 0.104655
H -3.130057 2.455997 -0.156990
H 3.189934 0.081402 -0.178538
H -2.028534 -2.912419 0.171734
H -5.079586 1.031546 -0.006159
H -4.484251 -3.225595 0.261514
H -6.006635 -1.265132 0.173165
H 3.310142 4.416948 0.332389
H 2.698826 4.394919 2.044136
H 1.615948 4.929686 0.687624
H 5.753884 -2.652938 -0.055905
H 4.681111 -3.886859 -0.847549
H 4.731251 -3.767851 0.950351


%chk=000283301-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000283301

0 1
O -0.667989 3.138426 -0.444768
O 1.789733 3.006964 1.012595
O 3.896793 -2.242529 -0.088738
O 2.443069 2.869731 -1.226617
O 2.167008 -3.796314 0.055108
N -2.414624 1.643918 -0.160914
C -0.657032 -0.557266 -0.021590
C -0.136629 0.775596 -0.125384
C -2.113272 -0.771201 0.047299
C -2.976673 0.366428 -0.015439
C 1.270578 0.999694 -0.159311
C 0.264191 -1.636874 0.016652
C -1.049903 1.942097 -0.250032
C 1.651286 -1.410381 -0.053113
C 2.158760 -0.087576 -0.142565
C -2.717697 -2.052110 0.181417
C -4.386505 0.221585 0.056852
C -4.113130 -2.200883 0.252422
C -4.951614 -1.057403 0.190126
C 1.859038 2.388581 -0.230690
C 2.552438 -2.603645 -0.021710
C 2.201891 4.430598 1.032849
C 4.863201 -3.366319 -0.070204
H -0.073052 -2.674153 0.092127
H -3.036640 2.453985 -0.244843
H 3.238085 0.073870 -0.190411
H -2.089452 -2.946128 0.234284
H -5.027063 1.110151 0.007190
H -4.552001 -3.198005 0.356786
H -6.039542 -1.168922 0.245569
H 3.223937 4.544948 0.634123
H 2.149737 4.724392 2.090456
H 1.494650 5.014169 0.420124
H 5.849940 -2.887934 -0.136250
H 4.684845 -4.034798 -0.928995
H 4.759239 -3.941393 0.865101


