%chk=000117923.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000117923

1 1
O -3.588960 -0.721456 -0.055313
N 2.832942 -0.005663 -0.007722
C 0.012940 -0.023456 -0.020709
C -1.424043 -0.027077 -0.029946
C 0.749066 1.189260 -0.000761
C 0.763514 -1.225844 -0.031057
C 2.134361 1.187712 0.006611
C 2.150583 -1.205783 -0.023463
C -2.288480 1.143975 -0.016752
C 4.312988 0.004421 0.016223
C -2.278878 -1.125561 -0.053245
C -3.574855 0.689168 -0.032668
H 0.216286 2.150522 0.008919
H 0.251295 -2.195790 -0.045162
H 2.709744 2.128933 0.024529
H 2.736831 -2.140584 -0.029284
H -1.956614 2.166731 0.002352
H -2.154126 -2.191837 -0.069643
H 4.743156 -0.877237 -0.500533
H 4.730071 0.899076 -0.489132
H 4.693356 0.000705 1.060204
H -4.559479 1.113784 -0.032647


%chk=000117923-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000117923

1 1
O -3.607628 -0.736551 -0.049783
N 2.853693 -0.007855 -0.017791
C 0.008905 -0.019420 -0.023395
C -1.443461 -0.012323 -0.029704
C 0.761125 1.197754 -0.007137
C 0.771513 -1.231707 -0.035675
C 2.153783 1.180573 -0.004202
C 2.162821 -1.203565 -0.032142
C -2.326530 1.151682 -0.015105
C 4.345790 -0.002888 0.029803
C -2.286291 -1.134237 -0.051205
C -3.618385 0.681420 -0.026574
H 0.261436 2.168327 0.000372
H 0.282118 -2.207987 -0.050466
H 2.747020 2.097234 0.009142
H 2.763548 -2.115239 -0.039940
H -2.043481 2.201966 0.002947
H -2.122109 -2.208962 -0.068570
H 4.734194 -0.890431 -0.491233
H 4.727872 0.897215 -0.474065
H 4.687767 -0.011969 1.077918
H -4.602003 1.140964 -0.022396


