%chk=000209594.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209594

0 1
O 2.937823 -2.202884 0.164991
O -3.047564 -0.779351 -0.756681
N 4.404283 1.129050 -0.663015
N 1.939870 0.774368 1.242634
C 3.638045 -0.983352 0.436738
C 3.762895 -0.197542 -0.886830
C 5.869052 1.064695 -0.355257
C 2.963461 -0.229233 1.607034
C 6.320076 2.480716 0.027753
C 6.716685 0.520377 -1.515794
C 0.701259 0.341028 0.708653
C -0.019245 1.230017 -0.129922
C 0.125224 -0.896094 1.076847
C -1.830849 -0.343307 -0.201363
C -1.289543 0.891322 -0.581893
C -1.147877 -1.238552 0.627584
C -4.221194 -0.201791 -0.289269
C -4.296136 0.697195 0.779963
C -5.359745 -0.629281 -0.997233
C -5.556499 1.180327 1.145685
C -6.600490 -0.130787 -0.607845
C -6.703709 0.773194 0.459387
H 4.634337 -1.366937 0.765603
H 2.750351 -0.025697 -1.316477
H 4.298714 -0.839718 -1.622178
H 5.997700 0.391141 0.532460
H 2.524734 -0.979061 2.306736
H 3.749281 0.316695 2.182181
H 4.248485 1.718256 -1.489588
H 2.362795 1.572264 0.748665
H 5.679371 2.898416 0.815470
H 6.283311 3.172876 -0.820072
H 7.348625 2.476848 0.403506
H 6.625151 1.134088 -2.417703
H 7.779854 0.500026 -1.250777
H 6.432326 -0.503592 -1.781684
H 2.015891 -2.032848 -0.126154
H 0.415660 2.186347 -0.412226
H 0.664174 -1.575679 1.736900
H -1.858396 1.560965 -1.225818
H -1.610041 -2.185721 0.904406
H -3.404018 1.007697 1.317090
H -5.253040 -1.330646 -1.820383
H -5.639895 1.880782 1.976557
H -7.498540 -0.446375 -1.138655
H -7.677952 1.155155 0.752274


%chk=000209594-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209594

0 1
O 3.092848 -2.288249 -0.127835
O -3.442921 -1.007289 -0.514067
N 4.765895 1.047143 -0.809586
N 1.902611 0.617611 0.457910
C 3.798395 -1.044022 0.235637
C 4.254031 -0.322918 -1.059914
C 6.079138 1.172379 -0.110168
C 2.949300 -0.128538 1.154868
C 6.327684 2.663925 0.193459
C 7.273696 0.553801 -0.885541
C 0.586331 0.199943 0.241448
C -0.308629 1.059060 -0.471923
C 0.083069 -1.052962 0.709479
C -2.125747 -0.547576 -0.211744
C -1.644454 0.688259 -0.703309
C -1.264284 -1.412012 0.489747
C -4.564780 -0.270062 -0.066936
C -4.498538 0.744289 0.918134
C -5.802921 -0.642828 -0.641636
C -5.691552 1.386813 1.321578
C -6.983346 0.007948 -0.226783
C -6.935939 1.027702 0.754961
H 4.667203 -1.409362 0.814005
H 3.363985 -0.222950 -1.712079
H 4.967652 -0.993532 -1.589504
H 5.980566 0.635869 0.855230
H 2.511458 -0.744010 1.961561
H 3.628160 0.604006 1.628003
H 4.776115 1.602567 -1.678126
H 2.227939 1.464159 -0.012254
H 5.496520 3.083857 0.786342
H 6.407920 3.246115 -0.745926
H 7.269541 2.802179 0.753839
H 7.444691 1.098058 -1.834625
H 8.202062 0.613375 -0.287749
H 7.098220 -0.510333 -1.126231
H 2.252991 -2.049321 -0.600998
H 0.055647 2.024983 -0.843577
H 0.732628 -1.745322 1.253511
H -2.312487 1.351036 -1.263596
H -1.649619 -2.371927 0.847801
H -3.539021 1.018251 1.366888
H -5.817433 -1.434072 -1.397395
H -5.643272 2.169380 2.087489
H -7.942017 -0.281318 -0.671933
H -7.854633 1.531293 1.073847


