%chk=000291170.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291170

0 1
O 0.577403 0.534350 2.238833
O -0.946266 -2.449241 -0.112674
O 3.407531 -0.329669 -0.696745
N 2.163281 1.084415 0.622964
N -0.758912 0.741022 1.964935
N 1.153782 -2.230420 -0.980361
N 4.236195 1.791739 -0.318265
C 0.122047 -0.263766 0.023174
C 1.260428 -0.003358 1.047940
C -1.082154 0.309043 0.772989
C 0.025322 -1.747532 -0.341128
C -2.417766 0.461602 0.176451
C -3.218756 -0.658397 -0.083610
C -2.886705 1.752651 -0.121771
C 3.289911 0.776588 -0.171013
C -4.483621 -0.485954 -0.653156
C -4.150620 1.914160 -0.692553
C 1.233739 -3.646196 -1.392967
C -4.949240 0.795977 -0.959507
C 5.357493 1.604092 -1.262825
H 0.268807 0.324658 -0.920045
H 1.816782 -0.906776 1.382643
H 2.049272 1.970598 1.115141
H 2.000115 -1.660583 -1.123938
H -2.847616 -1.664050 0.155798
H -2.270442 2.622581 0.099350
H -5.105869 -1.356770 -0.855815
H -4.516941 2.912378 -0.925484
H 0.296545 -4.183950 -1.145493
H 2.065427 -4.155766 -0.878209
H 1.390296 -3.717713 -2.482404
H -5.935045 0.925978 -1.403146
H 4.092733 2.727136 0.039915
H 5.226414 2.214210 -2.171871
H 5.433468 0.541712 -1.573902
H 6.306560 1.880653 -0.772551


%chk=000291170-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291170

0 1
O 0.639087 0.779844 2.284674
O -1.009733 -2.437726 0.383363
O 3.157135 -0.401755 -0.910467
N 2.275442 1.114312 0.615985
N -0.763638 1.027250 1.918626
N 1.130923 -2.392761 -0.572612
N 4.130520 1.716772 -0.709833
C 0.189330 -0.266468 0.142518
C 1.325564 0.118511 1.134793
C -1.011786 0.452426 0.749957
C 0.023533 -1.809612 0.003383
C -2.333839 0.589300 0.113506
C -2.585879 0.015977 -1.161912
C -3.374807 1.315052 0.761167
C 3.193783 0.757275 -0.361353
C -3.845125 0.170853 -1.778838
C -4.630900 1.462531 0.144090
C 1.220448 -3.840873 -0.786655
C -4.872069 0.893679 -1.130889
C 5.134861 1.471926 -1.751366
H 0.423731 0.141135 -0.857578
H 1.862531 -0.763122 1.525195
H 2.281972 2.015673 1.097778
H 1.936263 -1.780875 -0.807466
H -1.810839 -0.570581 -1.665009
H -3.181574 1.751605 1.745926
H -4.028099 -0.280561 -2.760065
H -5.424601 2.019403 0.654301
H 0.282777 -4.299398 -0.433243
H 2.067697 -4.275048 -0.224023
H 1.353166 -4.074763 -1.859262
H -5.850869 1.009023 -1.609690
H 4.134597 2.616303 -0.228425
H 5.038997 2.197057 -2.580417
H 4.964717 0.457342 -2.144087
H 6.160282 1.525695 -1.341378


