%chk=000280731.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280731

0 1
O 1.364561 0.508165 1.921560
N 3.204105 -0.130999 -1.142514
N -1.479678 -0.545277 -1.046700
C 3.658852 -0.080254 1.426625
C 4.016119 -1.462782 0.844650
C 4.483279 1.013467 0.715095
C 3.773833 -1.447506 -0.684540
C 4.166116 0.973963 -0.799681
C 2.185206 0.203945 1.091387
C 1.952994 0.090797 -0.392164
C 0.803549 0.121351 -1.078768
C -0.559974 0.280586 -0.532805
C -0.876561 1.284026 0.444601
C -2.790277 -0.438668 -0.601354
C -3.180029 0.533525 0.364207
C -2.171057 1.402868 0.881809
C -3.770446 -1.336461 -1.143620
C -4.548512 0.594107 0.772288
C -5.073270 -1.248473 -0.728070
C -5.467379 -0.274077 0.239101
H 3.821662 -0.054777 2.524437
H 3.410061 -2.250002 1.328326
H 5.068435 -1.706871 1.072266
H 5.559985 0.847853 0.895244
H 4.253940 2.007017 1.139272
H 4.714430 -1.627773 -1.242152
H 3.066974 -2.249087 -0.984509
H 3.724065 1.932915 -1.140051
H 5.087059 0.820145 -1.397560
H 0.828888 -0.018735 -2.174495
H -0.077491 1.909679 0.843915
H -2.445740 2.149186 1.627617
H -3.443800 -2.071990 -1.880091
H -4.840602 1.338647 1.511554
H -5.831895 -1.920965 -1.127767
H -6.512403 -0.237245 0.543386


%chk=000280731-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280731

0 1
O 1.759812 0.883130 2.167178
N 3.110374 -0.557858 -0.947153
N -1.590302 -0.457295 -1.038996
C 4.000590 0.413660 1.282719
C 4.480413 -1.062039 1.125626
C 4.555247 1.249889 0.088936
C 3.915057 -1.608649 -0.235185
C 3.990986 0.624647 -1.238200
C 2.467906 0.432565 1.214142
C 1.986161 -0.134883 -0.085977
C 0.721778 -0.325825 -0.602070
C -0.645968 -0.072929 -0.124992
C -1.002032 0.507639 1.146962
C -2.924234 -0.281868 -0.727337
C -3.364220 0.294299 0.530485
C -2.347468 0.685019 1.461019
C -3.905860 -0.687976 -1.691739
C -4.765359 0.443171 0.779094
C -5.266291 -0.530408 -1.421082
C -5.699418 0.038321 -0.178438
H 4.316727 0.837156 2.250059
H 4.130598 -1.670736 1.978662
H 5.586639 -1.080181 1.138663
H 5.660883 1.215014 0.112600
H 4.256378 2.308468 0.191952
H 4.728540 -1.919005 -0.915187
H 3.262297 -2.483178 -0.075551
H 3.394060 1.358908 -1.804553
H 4.804771 0.274907 -1.898298
H 0.721253 -0.774150 -1.604540
H -0.200944 0.794067 1.833950
H -2.636998 1.124910 2.422694
H -3.546397 -1.119026 -2.631170
H -5.095761 0.878655 1.729786
H -6.012859 -0.842002 -2.159722
H -6.771363 0.153885 0.016161


