%chk=000259572.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259572

0 1
O 0.307186 0.316676 -2.053907
O 6.420897 0.904345 1.755564
O -6.676908 0.677861 -1.349533
O 7.172057 -0.541533 -1.107544
O -6.859211 -0.212410 1.809614
N 0.495440 0.271129 -0.831606
N -0.393306 0.214605 0.093310
C 1.904312 0.267799 -0.366040
C 4.575804 0.240654 0.398712
C -1.803095 0.210680 -0.142623
C -4.594252 0.174687 -0.307590
C 2.900850 0.119288 -1.345365
C 2.228401 0.417171 0.990270
C 4.239723 0.103388 -0.956095
C 3.573573 0.408043 1.365760
C -2.576816 0.108520 1.036911
C -2.427441 0.304952 -1.398358
C -3.963604 0.090397 0.947103
C -3.820584 0.295922 -1.472296
C 6.002181 0.240173 0.840637
C -6.071081 0.168097 -0.436436
C 6.958063 -0.710591 0.065329
C -6.861258 -0.591194 0.665631
C 7.546098 -1.784663 0.911375
C -7.595392 -1.784221 0.155605
H 2.620093 0.022272 -2.402044
H 1.443468 0.543321 1.744416
H 5.026971 -0.005116 -1.713498
H 3.849619 0.542871 2.416053
H -4.566377 0.026315 1.860397
H -4.318233 0.388113 -2.442631
H -2.081086 0.048032 2.007163
H -1.829570 0.391964 -2.312240
H 8.074693 -1.365084 1.785034
H 6.782935 -2.474057 1.301163
H 8.275781 -2.390187 0.349084
H -8.283447 -1.509100 -0.662107
H -6.914774 -2.549469 -0.244220
H -8.197507 -2.258952 0.945903


%chk=000259572-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259572

0 1
O 0.324788 -0.064909 -2.110610
O 6.218380 -0.357681 2.287551
O -6.620849 -0.132395 -1.739730
O 7.166638 0.341850 -1.043196
O -6.780687 0.072387 1.791348
N 0.513579 -0.135470 -0.807362
N -0.411750 -0.190038 0.143339
C 1.906234 -0.158126 -0.326597
C 4.596463 -0.193160 0.508951
C -1.786467 -0.171839 -0.170066
C -4.637090 -0.160972 -0.366378
C 2.931932 -0.120020 -1.295401
C 2.195679 -0.214276 1.058878
C 4.276330 -0.136307 -0.877523
C 3.537818 -0.232808 1.464347
C -2.607484 -0.255036 0.999356
C -2.418514 -0.082640 -1.456172
C -4.005112 -0.250235 0.911074
C -3.818516 -0.079457 -1.531497
C 5.992320 -0.244750 1.044205
C -6.114315 -0.172757 -0.574734
C 7.238484 -0.156586 0.111275
C -7.117750 -0.235118 0.616844
C 8.530142 -0.665786 0.712475
C -8.526111 -0.650702 0.248481
H 2.661303 -0.073292 -2.352588
H 1.375602 -0.242544 1.778201
H 5.076146 -0.086979 -1.618375
H 3.800133 -0.279383 2.526032
H -4.614088 -0.296662 1.815531
H -4.316690 -0.014040 -2.504533
H -2.106148 -0.319603 1.969789
H -1.811283 -0.018621 -2.357723
H 8.715521 -0.182463 1.687734
H 8.448697 -1.749240 0.923293
H 9.363773 -0.481418 0.018948
H -8.912411 -0.013637 -0.566309
H -8.524350 -1.682278 -0.151919
H -9.176142 -0.592315 1.133962


