%chk=000280098.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280098

0 1
O 4.186516 -0.069109 0.076197
O -1.361190 3.286489 -0.084063
O 0.839604 3.131544 0.246551
O -4.287066 -0.396080 0.417843
O -3.937835 -2.167870 -0.907943
N -1.101571 -1.663575 -0.223846
C 0.578865 0.141397 -0.050046
C 0.206156 -1.245138 -0.145408
C -0.495709 1.098478 -0.034529
C 1.947767 0.475255 0.023140
C 1.225731 -2.260699 -0.163799
C 2.902609 -0.532950 0.000314
C -1.803906 0.666021 -0.108392
C -2.061436 -0.738039 -0.210672
C 2.547780 -1.916936 -0.093865
C -0.203473 2.548070 0.065422
C -3.466670 -1.235959 -0.311891
C 5.274283 -1.028321 0.064207
H 2.263083 1.524260 0.103809
H 0.905648 -3.305361 -0.237067
H -2.647432 1.369365 -0.083671
H 3.321532 -2.681028 -0.109188
H 6.148655 -0.365322 0.136422
H 5.283377 -1.583402 -0.877909
H 5.212227 -1.686818 0.935018
H -1.191829 4.266422 -0.016572
H -5.240714 -0.680293 0.390439


%chk=000280098-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000280098

0 1
O 4.259562 -0.066828 0.033708
O -1.464848 3.330716 0.112572
O 0.842342 3.182236 0.158809
O -4.422540 -0.215645 -0.157628
O -3.845048 -2.466001 -0.261973
N -1.100939 -1.675585 -0.160322
C 0.583636 0.172152 -0.023663
C 0.202248 -1.236176 -0.108866
C -0.509068 1.128075 0.008260
C 1.964499 0.503643 0.020980
C 1.224321 -2.239515 -0.143239
C 2.938429 -0.509416 -0.015776
C -1.828353 0.656248 -0.045728
C -2.084609 -0.747810 -0.130242
C 2.571579 -1.895654 -0.098229
C -0.267496 2.596707 0.098228
C -3.488057 -1.273040 -0.190860
C 5.337630 -1.064063 0.004418
H 2.281452 1.546016 0.085012
H 0.896123 -3.280914 -0.206761
H -2.664589 1.355240 -0.023616
H 3.335493 -2.677695 -0.125945
H 6.264807 -0.475801 0.055322
H 5.318151 -1.648865 -0.934591
H 5.279136 -1.743845 0.875353
H -1.240676 4.297675 0.174466
H -5.338182 -0.601454 -0.199189


