%chk=000213568.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213568

0 1
N 2.365818 -0.355050 -0.004056
N -2.356718 -0.388892 -0.004386
N 0.005107 -0.450244 0.000698
N -1.222752 1.689885 0.004120
N 1.202193 1.707251 0.004086
C 4.723180 -0.791448 0.143901
C 3.990816 -2.118819 -0.139815
C -4.707511 -0.858988 0.144820
C -3.956337 -2.175803 -0.138895
C 3.685830 0.335263 -0.000043
C 2.483809 -1.839174 -0.006282
C -3.686481 0.282432 0.000086
C -2.453429 -1.874553 -0.006173
C 1.170163 0.307556 0.000432
C -1.170674 0.290743 0.000444
C -0.014836 2.330102 0.007952
C -0.025401 3.822728 0.027105
H 5.151728 -0.796628 1.162138
H 5.567189 -0.646467 -0.550893
H 4.229722 -2.481952 -1.155429
H 4.313104 -2.907912 0.559741
H -5.553835 -0.726299 -0.549613
H -5.135460 -0.870028 1.163262
H -4.266939 -2.969240 0.561031
H -4.190500 -2.542601 -1.154296
H 3.730643 1.069541 0.833377
H 3.810043 0.909189 -0.944090
H 1.892960 -2.267411 -0.844496
H 2.058335 -2.249867 0.935051
H -3.819312 0.854221 -0.944083
H -3.741465 1.016245 0.833308
H -2.021639 -2.278923 0.935022
H -1.856921 -2.294439 -0.844604
H -0.927954 4.227386 -0.456258
H -0.015000 4.191242 1.064968
H 0.859426 4.239853 -0.477933


%chk=000213568-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213568

0 1
N 2.348765 -0.359077 -0.000593
N -2.339670 -0.392754 -0.000657
N 0.005059 -0.449761 0.011671
N -1.225799 1.673842 -0.059535
N 1.205264 1.691264 -0.059671
C 4.650205 -0.818691 0.341444
C 3.966157 -2.077408 -0.255687
C -4.633994 -0.885319 0.342518
C -3.932523 -2.133998 -0.255408
C 3.664984 0.325254 0.000605
C 2.461339 -1.836702 0.017000
C -3.665626 0.272523 0.000535
C -2.431136 -1.871906 0.016554
C 1.154999 0.304535 -0.016207
C -1.155535 0.287843 -0.016216
C -0.014784 2.306374 -0.071083
C -0.025228 3.815170 -0.076779
H 4.743570 -0.922430 1.438509
H 5.656553 -0.637310 -0.072075
H 4.149510 -2.126708 -1.345154
H 4.324938 -3.018397 0.194316
H -5.643327 -0.718371 -0.069800
H -4.724494 -0.990390 1.439702
H -4.277559 -3.080135 0.194538
H -4.115779 -2.185561 -1.344787
H 3.669212 1.151062 0.730944
H 3.870764 0.765832 -0.995067
H 1.795849 -2.283776 -0.741164
H 2.149155 -2.234862 1.003138
H -3.878232 0.709201 -0.995435
H -3.681449 1.098761 0.730212
H -2.112785 -2.265815 1.002433
H -1.759656 -2.309216 -0.742045
H -0.940852 4.188948 -0.561383
H -0.011829 4.195271 0.962450
H 0.870836 4.201604 -0.587628


