%chk=000207747.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207747

0 1
O -0.183210 1.525367 -0.289710
O -0.077152 -2.438580 -0.718887
N -1.415210 -0.800270 0.130607
N 4.587045 -1.120545 0.943047
C -2.671476 -1.570279 -0.087147
C -3.435401 -1.712472 1.247856
C -3.532355 -0.854621 -1.136723
C -2.719985 -2.645413 2.219076
C -0.180773 -1.314867 -0.240287
C 1.023951 -0.460836 0.031066
C 1.040281 0.950292 -0.007733
C 2.215410 -1.135366 0.307819
C 3.406611 -0.422519 0.552787
C 2.217437 1.672100 0.230502
C 3.397952 0.985669 0.511905
C -0.249739 2.976588 -0.453741
C -1.660757 3.204052 -0.902072
C -2.197377 4.415024 -1.018548
H -2.389157 -2.591799 -0.470912
H -4.452466 -2.099384 1.039425
H -3.583622 -0.720674 1.716071
H -1.508400 0.153292 0.478617
H -4.420901 -1.445365 -1.384991
H -3.872058 0.129112 -0.798910
H -2.971439 -0.707599 -2.069014
H -1.715144 -2.277155 2.463152
H -3.273938 -2.744599 3.158389
H -2.596037 -3.650887 1.798199
H 2.206627 -2.230404 0.324341
H 2.228111 2.757713 0.204805
H 4.311275 1.545022 0.709164
H -0.021962 3.444264 0.521157
H 0.486453 3.285685 -1.219146
H 5.451829 -0.648228 0.713322
H 4.621716 -2.088064 0.644881
H -2.209246 2.284564 -1.133758
H -3.213707 4.578052 -1.351913
H -1.676589 5.335529 -0.796593


%chk=000207747-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207747

0 1
O -0.242655 1.423247 0.010567
O 0.134073 -2.832187 -0.108083
N -1.323305 -1.024638 -0.051754
N 4.833126 -1.115308 0.073612
C -2.536039 -1.867101 -0.080090
C -3.709963 -1.113672 0.590834
C -2.873213 -2.298340 -1.528322
C -3.474525 -0.789742 2.081840
C -0.058984 -1.568720 -0.065212
C 1.115185 -0.607091 -0.012286
C 1.046351 0.819627 0.029569
C 2.388513 -1.217882 0.003065
C 3.592686 -0.469969 0.061394
C 2.236562 1.579133 0.093971
C 3.496486 0.947533 0.109595
C -0.321822 2.898853 -0.007658
C -1.769134 3.273839 -0.186941
C -2.451482 4.077232 0.665141
H -2.301430 -2.779605 0.501953
H -4.617114 -1.739451 0.483236
H -3.910410 -0.177840 0.026669
H -1.401198 0.000385 -0.031437
H -3.741745 -2.983118 -1.537735
H -3.115589 -1.419281 -2.154766
H -2.011918 -2.824278 -1.973642
H -2.591499 -0.139498 2.217615
H -4.348338 -0.273242 2.519863
H -3.298899 -1.714565 2.662223
H 2.395750 -2.313985 -0.031367
H 2.202088 2.671351 0.139065
H 4.405229 1.559401 0.160544
H 0.086320 3.309781 0.937166
H 0.286428 3.275321 -0.857448
H 5.698205 -0.586301 0.118454
H 4.887043 -2.128605 0.041037
H -2.257190 2.874448 -1.086612
H -3.494062 4.356343 0.478425
H -1.986936 4.480324 1.573619


