%chk=000298756.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298756

0 1
O 1.562045 0.657819 -0.000082
O 0.898950 -1.548283 0.001160
O -4.254176 2.307853 -0.001508
O -2.101583 2.420765 -0.001419
N -0.630376 0.259968 -0.000058
N -3.154639 1.782577 -0.001292
C -1.868924 -0.413909 0.000069
C -3.084940 0.323906 -0.000556
C -1.933482 -1.830225 0.000806
C -4.322174 -0.370989 -0.000456
C -3.154582 -2.481428 0.000890
C -4.361119 -1.751657 0.000245
C 2.934082 0.302203 0.000006
C 0.630441 -0.373537 0.000581
C 3.583065 0.193687 -1.231757
C 3.582992 0.193495 1.231791
C 4.964712 -0.019882 -1.216090
C 4.964638 -0.020078 1.216173
C 5.650509 -0.126065 0.000053
H -1.004139 -2.417281 0.001326
H -5.249655 0.217601 -0.000949
H -0.637123 1.313516 -0.000689
H -3.187196 -3.574408 0.001464
H -5.314283 -2.278879 0.000301
H 3.028126 0.278764 -2.163222
H 3.027998 0.278407 2.163238
H 5.507732 -0.106127 -2.157390
H 5.507601 -0.106480 2.157491
H 6.726800 -0.294632 0.000073


%chk=000298756-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298756

0 1
O 1.554722 0.680511 -0.000555
O 0.922755 -1.597655 0.002378
O -4.279327 2.361661 -0.002419
O -2.009373 2.426949 -0.003257
N -0.641093 0.199744 -0.000183
N -3.139151 1.762951 -0.002533
C -1.878153 -0.457866 0.000215
C -3.107262 0.292750 -0.000933
C -1.979980 -1.881060 0.001786
C -4.366886 -0.360442 -0.000638
C -3.233604 -2.512256 0.002097
C -4.436547 -1.759361 0.000867
C 2.953032 0.351496 -0.000345
C 0.621713 -0.385304 0.001028
C 3.624657 0.238713 -1.232000
C 3.623811 0.235488 1.231482
C 5.017676 -0.000173 -1.224916
C 5.016821 -0.003414 1.224734
C 5.714370 -0.121415 -0.000009
H -1.058513 -2.466668 0.002760
H -5.265953 0.260721 -0.001564
H -0.697765 1.235982 -0.001611
H -3.274701 -3.606675 0.003282
H -5.408212 -2.261371 0.001083
H 3.068162 0.340677 -2.168552
H 3.066692 0.334945 2.167932
H 5.555625 -0.089792 -2.174567
H 5.554110 -0.095563 2.174517
H 6.793674 -0.306870 0.000120


