%chk=000288297.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288297

0 1
N 0.845531 0.568797 0.436069
N -0.935435 2.543638 -0.319465
C -1.558993 0.147549 0.035561
C -0.221311 -0.362745 0.244325
C -2.622386 -0.804467 0.045666
C -1.920443 1.530674 -0.182256
C 0.022218 -1.725277 0.311668
C -2.338383 -2.205790 0.113952
C -3.983255 -0.375143 -0.014387
C -1.045870 -2.649994 0.218362
C -3.257062 1.919795 -0.222623
C 2.216428 0.277532 0.195326
C -4.287104 0.960278 -0.115208
C 3.189239 0.913497 0.997013
C 2.612421 -0.540461 -0.882349
C 4.541481 0.720926 0.714784
C 3.970546 -0.721614 -1.140674
C 4.939339 -0.096560 -0.347970
H 1.028114 -2.109063 0.475185
H 0.649848 1.316889 1.111948
H -3.169874 -2.906323 0.080854
H -4.769410 -1.124718 0.027411
H -0.819374 -3.715889 0.258222
H -3.528198 2.964265 -0.346985
H -5.323848 1.297669 -0.136636
H 2.893869 1.545384 1.830006
H 1.865843 -1.015818 -1.515858
H -0.087070 2.277665 -0.811454
H -1.280942 3.436250 -0.652098
H 5.293846 1.210719 1.333049
H 4.278270 -1.354728 -1.973090
H 5.995064 -0.244637 -0.557750


%chk=000288297-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288297

0 1
N 0.845788 0.481667 0.420610
N -0.887039 2.496939 -0.321354
C -1.583600 0.113321 0.034170
C -0.242141 -0.418928 0.209858
C -2.693425 -0.828146 0.046144
C -1.895025 1.523511 -0.155517
C -0.031784 -1.808746 0.262741
C -2.431808 -2.236999 0.106013
C -4.045621 -0.356091 -0.005125
C -1.124581 -2.715416 0.185269
C -3.241909 1.943226 -0.179847
C 2.221002 0.257951 0.174233
C -4.309660 1.011427 -0.086979
C 3.177195 0.985245 0.939671
C 2.683653 -0.603525 -0.861116
C 4.556236 0.853418 0.676571
C 4.066017 -0.733565 -1.106844
C 5.014883 -0.011608 -0.344332
H 0.978881 -2.192913 0.425464
H 0.628645 1.286945 1.014179
H -3.281512 -2.928789 0.093735
H -4.861374 -1.086572 0.021377
H -0.929306 -3.792352 0.232954
H -3.463378 3.010230 -0.307911
H -5.342225 1.376915 -0.112612
H 2.833943 1.645539 1.746489
H 1.964541 -1.147431 -1.480647
H 0.017247 2.207623 -0.692787
H -1.194550 3.441759 -0.549421
H 5.274551 1.421751 1.278427
H 4.403245 -1.398734 -1.910208
H 6.086211 -0.119352 -0.542609


