%chk=000294230.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294230

0 1
O 5.035092 -1.949561 -0.000119
O 6.545710 -0.117034 0.000794
O -1.108423 0.873741 -0.000261
O 0.151036 -1.110270 -0.000563
N 1.106451 1.047089 -0.000641
N -4.826955 -1.140412 -0.000234
N -2.254753 0.054830 -0.000434
C 4.327059 -0.761193 -0.000042
C 5.231917 0.344005 0.000496
C 2.505501 0.747042 -0.000215
C 2.962005 -0.599502 -0.000412
C 4.789178 1.646618 0.000668
C 3.390420 1.837589 0.000320
C 6.456656 -1.578023 0.000302
C 0.083956 0.083947 -0.000620
C -4.681949 0.214326 -0.000011
C -5.789547 1.089765 0.000189
C -7.075418 0.542261 0.000149
C -3.318395 0.801571 0.000030
C -7.233842 -0.845371 -0.000081
C -6.081795 -1.651825 -0.000267
H 2.274609 -1.451141 -0.000817
H 5.473701 2.491077 0.001079
H 3.013732 2.858192 0.000466
H 6.897346 -1.945041 -0.935813
H 6.896952 -1.945637 0.936366
H 0.840458 2.036157 -0.000635
H -5.651179 2.168152 0.000362
H -7.947812 1.196654 0.000298
H -3.295275 1.907537 0.000515
H -8.223228 -1.296684 -0.000117
H -6.149307 -2.747660 -0.000450


%chk=000294230-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294230

0 1
O 5.202541 -1.928521 0.000128
O 6.652974 -0.009304 0.000593
O -1.127420 0.763542 -0.000299
O 0.174533 -1.255065 -0.000418
N 1.110564 0.924767 -0.000317
N -4.958591 -1.167175 -0.000468
N -2.328884 -0.091240 -0.000397
C 4.440967 -0.735056 0.000098
C 5.291645 0.389686 0.000369
C 2.514298 0.683963 -0.000087
C 3.050192 -0.639525 -0.000136
C 4.777364 1.687244 0.000421
C 3.365065 1.821979 0.000189
C 6.626511 -1.497337 0.000299
C 0.096633 -0.016663 -0.000523
C -4.751179 0.191910 -0.000098
C -5.824025 1.126864 0.000268
C -7.151833 0.648848 0.000252
C -3.371547 0.712214 -0.000078
C -7.372277 -0.746254 -0.000128
C -6.244408 -1.606113 -0.000476
H 2.400827 -1.515709 -0.000346
H 5.432242 2.561581 0.000637
H 2.927941 2.827048 0.000225
H 7.111928 -1.865291 -0.920049
H 7.111814 -1.865650 0.920558
H 0.804596 1.900102 -0.000294
H -5.615763 2.202423 0.000558
H -7.993523 1.348948 0.000529
H -3.252735 1.807530 0.000223
H -8.383791 -1.163639 -0.000155
H -6.372755 -2.694908 -0.000775


