%chk=000279709.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279709

0 1
O -0.625983 -0.173744 0.923964
O 1.547092 0.698046 1.704412
O 0.131239 -1.452858 -0.778177
N -4.194074 -0.293459 -0.139843
C -1.984648 -0.754347 0.837476
C -2.519506 -0.586080 2.258994
C -2.746000 0.083387 -0.203726
C -4.024957 -0.869670 2.263405
C -4.758493 -0.009225 1.221593
C -4.967082 0.429718 -1.204502
C 1.658669 0.134887 0.392019
C 0.344165 -0.628413 0.076121
C -6.310275 -0.228084 -1.378930
C 1.863576 1.235470 -0.640660
C 2.855229 -0.799949 0.450567
C 1.607796 1.008530 -1.999695
C 3.044652 -1.781269 -0.532379
C 2.350654 2.479500 -0.217799
C 3.790590 -0.652682 1.484580
C -7.401886 0.435275 -1.752259
C 1.824967 2.030239 -2.927831
C 4.168171 -2.609935 -0.478479
C 2.565003 3.498339 -1.149745
C 4.911576 -1.485621 1.533207
C 2.300785 3.275859 -2.504929
C 5.102852 -2.463155 0.551786
H -1.892141 -1.817376 0.528189
H -2.309762 0.438392 2.625048
H -1.987134 -1.264466 2.952800
H -2.553010 1.164073 -0.033653
H -2.362402 -0.160266 -1.220456
H -4.205469 -1.943177 2.047752
H -4.445252 -0.680065 3.268385
H -5.837316 -0.280566 1.206241
H -4.700259 1.064399 1.500221
H -4.411030 0.336377 -2.168934
H -5.068780 1.519263 -1.006488
H -6.314805 -1.306528 -1.196439
H 0.679992 1.164540 1.814308
H 1.243197 0.035902 -2.339003
H 2.311044 -1.910514 -1.332487
H 2.568805 2.641631 0.840106
H 3.633461 0.109456 2.251798
H -7.432376 1.498041 -1.939162
H -8.358354 -0.043600 -1.904909
H 1.625863 1.852809 -3.983737
H 4.313158 -3.372941 -1.241528
H 2.943291 4.464364 -0.819233
H 5.635869 -1.371317 2.337679
H 2.469500 4.069643 -3.230730
H 5.977299 -3.110236 0.590061


%chk=000279709-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279709

0 1
O -0.583664 0.030196 1.106860
O 1.741788 0.898897 1.768872
O 0.141771 -1.356528 -0.622288
N -4.148104 -0.262932 -0.105110
C -1.977746 -0.528620 1.021933
C -2.618019 -0.310581 2.395596
C -2.745876 0.211306 -0.090879
C -4.112295 -0.712875 2.336856
C -4.831923 0.012938 1.182337
C -4.902920 0.219209 -1.290178
C 1.734696 0.253281 0.453525
C 0.376982 -0.477284 0.231582
C -6.188801 -0.554982 -1.497944
C 1.909862 1.327346 -0.657911
C 2.888111 -0.775024 0.442830
C 1.379128 1.186939 -1.964125
C 3.286451 -1.404445 -0.761827
C 2.670229 2.480840 -0.340017
C 3.544924 -1.107415 1.651623
C -7.402081 0.003880 -1.731738
C 1.602192 2.190667 -2.934998
C 4.327218 -2.358065 -0.755072
C 2.895495 3.477900 -1.312620
C 4.591190 -2.057834 1.654172
C 2.360994 3.338286 -2.615105
C 4.985180 -2.688399 0.452585
H -1.899792 -1.600065 0.764003
H -2.530373 0.761513 2.662521
H -2.078891 -0.891599 3.165061
H -2.668002 1.313722 0.096760
H -2.281470 -0.007196 -1.068435
H -4.202615 -1.804679 2.182003
H -4.603268 -0.468050 3.297030
H -5.876792 -0.334756 1.102011
H -4.861781 1.115000 1.394701
H -4.250148 0.066165 -2.173736
H -5.126247 1.314806 -1.236400
H -6.077294 -1.648868 -1.470319
H 0.810609 1.184207 1.964395
H 0.793502 0.300389 -2.231236
H 2.788909 -1.154622 -1.703372
H 3.069208 2.583460 0.673465
H 3.234354 -0.608726 2.572922
H -7.539487 1.092665 -1.753818
H -8.291283 -0.609857 -1.913889
H 1.183654 2.072162 -3.940931
H 4.625584 -2.840665 -1.692531
H 3.487714 4.363401 -1.054951
H 5.096710 -2.304318 2.594948
H 2.534318 4.114068 -3.369414
H 5.795602 -3.426261 0.455253


