%chk=000238387.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238387

0 1
O 5.099333 1.361653 0.485553
O -5.583854 -0.382741 0.576568
N -4.702523 2.190310 -0.110711
C 2.807849 0.658395 0.109772
C 2.234093 -0.687926 -0.443371
C 0.789141 -0.878609 0.029192
C -0.058936 0.266372 -0.601148
C 4.289777 0.534152 -0.364407
C 2.005081 1.805827 -0.526106
C 3.304099 -1.729732 -0.072423
C 0.507815 1.649449 -0.204240
C 4.644078 -0.967721 -0.203805
C 0.198238 -2.230854 -0.392611
C 2.779576 0.773083 1.638302
C -1.524664 0.109736 -0.252747
C -1.206777 -2.391259 0.196839
C -2.058620 -1.154753 0.089279
C -2.382687 1.214121 -0.331323
C -3.424222 -1.292095 0.364765
C -3.750094 1.096232 -0.058489
C -4.262628 -0.172687 0.293164
H 2.214731 -0.627116 -1.562603
H 0.741776 -0.800179 1.141633
H 0.013352 0.175639 -1.717693
H 4.429554 0.884592 -1.405958
H 2.158714 1.829965 -1.619948
H 2.371235 2.779239 -0.148150
H 3.268310 -2.607541 -0.735003
H 3.161140 -2.104671 0.954943
H 0.343728 1.814172 0.879604
H -0.057118 2.446944 -0.723756
H 5.266686 -1.113481 0.695712
H 5.230209 -1.334771 -1.058749
H 0.845677 -3.059323 -0.050604
H 0.161263 -2.310060 -1.495674
H 3.360737 1.649862 1.960250
H 1.762340 0.878138 2.026969
H 3.237974 -0.097033 2.119171
H -1.131495 -2.669517 1.271339
H -1.718127 -3.245246 -0.294655
H 6.039025 1.279436 0.242871
H -1.981758 2.189117 -0.612748
H -3.856072 -2.253894 0.634662
H -4.720285 2.604918 -1.041425
H -4.438330 2.925388 0.543853
H -6.104141 0.473967 0.496209


%chk=000238387-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238387

0 1
O 5.206675 1.485674 0.218716
O -5.714116 -0.310286 0.448880
N -4.809012 2.150604 -0.118151
C 2.863731 0.650060 0.132073
C 2.261023 -0.692666 -0.393124
C 0.797714 -0.884999 0.039472
C -0.048399 0.291081 -0.545103
C 4.309528 0.505366 -0.410117
C 2.044809 1.818414 -0.464288
C 3.327165 -1.760036 -0.022997
C 0.532398 1.678530 -0.139273
C 4.688792 -0.985594 -0.122136
C 0.186817 -2.226383 -0.418490
C 2.903394 0.748595 1.680579
C -1.545815 0.121024 -0.233231
C -1.216778 -2.407765 0.192070
C -2.095326 -1.163218 0.074903
C -2.433188 1.228221 -0.301057
C -3.485157 -1.311117 0.303959
C -3.814535 1.085866 -0.072360
C -4.343242 -0.199107 0.233343
H 2.252858 -0.617387 -1.506400
H 0.741278 -0.851685 1.148872
H 0.068518 0.217346 -1.653083
H 4.292328 0.678433 -1.510648
H 2.178034 1.825488 -1.567443
H 2.422500 2.788904 -0.088758
H 3.292229 -2.629938 -0.702666
H 3.161297 -2.141971 1.002187
H 0.352763 1.847074 0.940527
H -0.007672 2.483828 -0.672826
H 5.242907 -1.031362 0.833883
H 5.345268 -1.401425 -0.908486
H 0.834649 -3.071425 -0.116607
H 0.128152 -2.240412 -1.526689
H 3.464371 1.652496 1.972669
H 1.891912 0.810123 2.116622
H 3.413710 -0.116465 2.139530
H -1.108446 -2.661738 1.267696
H -1.734365 -3.268704 -0.273152
H 6.115346 1.377712 -0.158085
H -2.048126 2.226231 -0.538320
H -3.908106 -2.294549 0.536242
H -4.941071 2.579162 -1.040655
H -4.719557 2.857718 0.619615
H -6.044052 0.639779 0.324608


