%chk=000225054.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225054

0 1
O -2.897003 -2.727383 -0.132003
O -5.120924 1.294519 -0.627719
O 7.286170 0.052618 -1.468018
O 6.972398 -0.511348 0.674600
N -0.400513 -1.055611 0.609370
N -2.906755 1.424406 -0.014828
N -0.491710 1.234570 0.647316
N -4.011535 -0.723483 -0.379911
C 1.736057 0.167967 1.228031
C 2.648278 -0.015066 0.005113
C 0.301767 0.128156 0.835817
C -1.711580 -0.689238 0.255708
C -1.739959 0.731145 0.288227
C 4.123726 0.020050 0.415520
C -2.846794 -1.515360 -0.081441
C -4.093548 0.701388 -0.361263
C 5.039339 -0.122656 -0.804223
C -2.930660 2.906577 0.025514
C -5.270725 -1.430619 -0.745090
C 6.475617 -0.227326 -0.388290
H 1.955792 -0.596864 2.002907
H 1.949825 1.150805 1.715222
H 2.415691 -0.968800 -0.507240
H 2.436449 0.785713 -0.734702
H 4.353432 0.966965 0.946803
H 4.345152 -0.787376 1.145672
H -0.080967 -2.007012 0.671202
H 4.907813 0.731612 -1.506193
H 4.773539 -1.024259 -1.401121
H -3.937841 3.278620 -0.244742
H -2.192989 3.319730 -0.685380
H -2.676028 3.265459 1.038825
H -5.104020 -2.524579 -0.739212
H -5.605386 -1.124927 -1.751535
H -6.071212 -1.187066 -0.025174
H 8.254507 -0.014623 -1.251762


%chk=000225054-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225054

0 1
O -3.501803 -2.739831 0.573779
O -4.938078 1.527737 -0.856004
O 7.352395 0.880893 -1.314414
O 7.011361 -0.093863 0.765173
N -0.684993 -1.442211 0.796299
N -2.663537 1.277978 -0.332204
N -0.319297 0.741215 0.286174
N -4.202829 -0.581795 -0.143807
C 1.702704 -0.590286 1.065879
C 2.651488 -0.038148 -0.029468
C 0.253160 -0.421754 0.714586
C -1.922101 -0.917187 0.407881
C -1.659863 0.425325 0.099949
C 4.131656 -0.124159 0.396215
C -3.217494 -1.530852 0.308853
C -3.988020 0.790279 -0.467712
C 5.071724 0.430709 -0.690111
C -2.367927 2.688387 -0.648671
C -5.597058 -1.057466 -0.296865
C 6.535028 0.358012 -0.298720
H 1.919240 -1.660148 1.251969
H 1.908932 -0.055735 2.014883
H 2.492546 -0.603264 -0.969626
H 2.367566 1.010319 -0.238508
H 4.287722 0.438225 1.336905
H 4.407124 -1.173267 0.617777
H -0.528569 -2.407322 1.086927
H 4.834197 1.487352 -0.922261
H 4.948946 -0.117250 -1.645000
H -3.304529 3.156702 -0.984086
H -1.606013 2.745301 -1.443922
H -1.983344 3.205515 0.246463
H -5.609869 -2.123545 -0.026510
H -5.932484 -0.916830 -1.337217
H -6.267903 -0.483050 0.362692
H 8.305326 0.820716 -1.031299


