%chk=000264308.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264308

0 1
O 0.444429 -1.757895 -0.000027
O 4.277133 1.386577 0.019762
N -0.688773 0.253903 -0.002308
N 5.412719 -0.634677 -0.005837
N 6.678352 0.003663 0.004875
N -2.674069 3.266186 -0.009855
C 1.762055 0.268913 -0.004877
C 2.981082 -0.653767 -0.010432
C 0.485561 -0.545126 -0.002317
C -2.030197 -0.226335 0.000210
C 4.259354 0.177698 0.003429
C -3.094251 0.716219 -0.001596
C -2.333520 -1.602727 0.004444
C -4.427848 0.263100 0.000992
C -3.658565 -2.026165 0.006898
C -4.710747 -1.098672 0.005217
C -2.857831 2.123521 -0.006117
H 1.809012 0.949140 0.877163
H 1.803741 0.953082 -0.883788
H 2.947354 -1.318973 -0.900199
H 2.941070 -1.337699 0.865034
H -0.573840 1.273758 -0.004000
H -1.523477 -2.343526 0.005815
H -5.238935 0.994692 -0.000374
H -3.880522 -3.095341 0.010195
H -5.742891 -1.444477 0.007212
H 5.361977 -1.652994 -0.019326
H 7.209175 -0.285696 0.832016
H 7.212353 -0.264284 -0.827412


%chk=000264308-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000264308

0 1
O 0.467897 -1.905907 0.391637
O 4.358980 0.654621 1.276505
N -0.662218 0.109468 -0.035356
N 5.441809 -0.478116 -0.435984
N 6.750192 -0.073573 -0.057589
N -2.257046 3.154570 -0.773658
C 1.788820 0.148731 0.095496
C 2.999970 -0.736819 -0.245587
C 0.491500 -0.662563 0.157287
C -2.016397 -0.298131 0.019293
C 4.301401 -0.112657 0.268065
C -3.025550 0.694309 -0.230410
C -2.419138 -1.629059 0.305096
C -4.401051 0.345355 -0.186992
C -3.790721 -1.953287 0.342333
C -4.786977 -0.977166 0.099233
C -2.629441 2.042790 -0.527250
H 1.977166 0.598220 1.092769
H 1.696953 0.991689 -0.615315
H 3.056241 -0.941085 -1.331194
H 2.853695 -1.714947 0.254359
H -0.506048 1.104822 -0.229649
H -1.652074 -2.382172 0.490688
H -5.149895 1.119726 -0.379591
H -4.083121 -2.984994 0.565495
H -5.847293 -1.244892 0.132505
H 5.392212 -1.108938 -1.237709
H 6.948720 -0.365067 0.910208
H 6.851313 0.947168 -0.149890


