%chk=000264357.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264357

0 1
O 0.009634 1.727052 -1.558370
O 4.506705 0.879265 0.277465
O 2.891233 2.179915 -1.749303
O -4.518522 -0.411903 -1.714760
O -0.766615 -4.427637 -1.219277
N 0.191765 -2.466303 -0.565844
N -5.612694 0.757640 0.619512
N 4.093918 -1.194452 2.962270
C -0.770386 -2.271474 0.547705
C -0.049114 -2.256689 1.912463
C 0.491008 -0.914562 2.420189
C -1.649424 -1.053171 0.237405
C 1.160413 -0.129103 1.330918
C 0.344517 0.464383 0.358321
C -1.127330 0.296774 0.446396
C 2.566395 -0.011797 1.250029
C 0.924924 1.231003 -0.686808
C -2.868808 -1.317192 -0.274632
C -1.867707 1.392176 0.755222
C 3.143442 0.755270 0.209499
C 2.327398 1.403308 -0.740901
C -3.891892 -0.348999 -0.676996
C -3.292215 1.503030 0.928911
C 0.085269 -3.576710 -1.413565
C -4.237028 0.723860 0.341971
C 3.412105 -0.660058 2.194675
C 1.091245 -3.624736 -2.528052
C 0.460973 2.415449 -2.757961
C 5.256408 0.731992 -0.962766
C 3.324903 3.488445 -1.267854
C -6.168582 1.885002 1.401285
H -1.439737 -3.192339 0.561978
H 0.785855 -2.990995 1.870511
H -0.750809 -2.656838 2.674991
H 1.173470 -1.098865 3.277131
H -0.343407 -0.311291 2.847211
H 0.874575 -1.733496 -0.722535
H -3.178302 -2.354091 -0.476394
H -1.332042 2.338192 0.928596
H -3.601335 2.328258 1.576524
H 0.954790 -4.550563 -3.112200
H 0.975447 -2.785832 -3.226833
H 2.125638 -3.624839 -2.161815
H -6.212650 0.478762 -0.165905
H -0.468842 2.460015 -3.340112
H 0.822840 3.410774 -2.489461
H 1.237302 1.838721 -3.272056
H 6.244477 1.107611 -0.670186
H 4.821682 1.318087 -1.779757
H 5.292993 -0.333455 -1.209168
H 3.741736 3.940390 -2.173496
H 2.467930 4.052674 -0.892584
H 4.086577 3.368369 -0.490286
H -5.707182 1.913097 2.404960
H -7.250647 1.723087 1.544642
H -6.022798 2.868885 0.924998


%chk=000264357-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264357

0 1
O 0.115295 1.947370 -1.450160
O 4.570329 1.080110 0.445542
O 2.911269 2.413325 -1.494214
O -5.380162 -1.489613 0.708244
O -0.727332 -4.202233 -1.810078
N 0.200944 -2.305726 -0.816939
N -5.670244 1.049208 0.739553
N 4.187503 -1.278777 3.038996
C -0.675085 -2.354533 0.373001
C 0.124647 -2.529869 1.702816
C 0.574054 -1.197435 2.366665
C -1.662476 -1.164406 0.443390
C 1.199920 -0.246383 1.365212
C 0.358543 0.393349 0.406444
C -1.131805 0.179653 0.439025
C 2.610996 -0.036533 1.333012
C 0.955795 1.266905 -0.559129
C -3.008826 -1.552160 0.522290
C -1.908333 1.358272 0.491857
C 3.193497 0.834361 0.367124
C 2.360275 1.502259 -0.563008
C -4.260006 -0.839827 0.629745
C -3.301402 1.581014 0.579919
C 0.101717 -3.242693 -1.838014
C -4.364535 0.657934 0.646435
C 3.477668 -0.706185 2.264846
C 1.071487 -3.041547 -3.000902
C 0.381223 1.777329 -2.900375
C 5.372826 0.746704 -0.759530
C 3.311559 3.708897 -0.884030
C -6.155970 2.423278 0.777988
H -1.260741 -3.276534 0.215858
H 1.001163 -3.170184 1.490997
H -0.511097 -3.075255 2.425556
H 1.275851 -1.423284 3.187567
H -0.313248 -0.711835 2.814235
H 0.883548 -1.551498 -0.894391
H -3.195456 -2.634442 0.492937
H -1.323163 2.285110 0.466572
H -3.587331 2.640389 0.608833
H 1.716059 -3.933000 -3.090625
H 0.494175 -2.961488 -3.938005
H 1.711374 -2.147596 -2.893337
H -6.310977 0.236463 0.780130
H -0.381026 2.393114 -3.400081
H 1.395782 2.125451 -3.152830
H 0.247114 0.715778 -3.182012
H 6.396922 1.062458 -0.513456
H 4.995420 1.287073 -1.644544
H 5.347588 -0.344944 -0.931415
H 3.739628 4.301086 -1.706722
H 2.424536 4.220011 -0.467896
H 4.066024 3.543908 -0.094240
H -5.754270 2.974530 1.651245
H -7.254700 2.415101 0.853348
H -5.877046 2.981634 -0.137546


