%chk=000253085.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253085

0 1
O 6.419843 1.490525 0.507893
O -0.835702 -2.773308 -0.389494
O -6.046749 2.168501 -0.787294
O -6.712540 0.853359 0.795696
N -5.887110 1.235315 -0.017337
C -2.165156 -0.824544 -0.169297
C 2.844198 -0.578256 0.029159
C -0.852828 -1.571381 -0.220144
C 1.581670 -1.292234 -0.135681
C -2.397345 0.252113 -1.035632
C -3.149152 -1.238230 0.738043
C 2.892215 0.783138 0.406653
C 4.052918 -1.266111 -0.191633
C -4.592660 0.514851 -0.072399
C 0.354023 -0.746069 -0.039627
C 5.299070 0.723308 0.325659
C -3.617831 0.927160 -0.993455
C -4.370935 -0.565294 0.794310
C 4.103508 1.440023 0.557241
C 5.284659 -0.628582 -0.048699
C 7.714636 0.870860 0.302799
H 1.670600 -2.368421 -0.360448
H -1.629951 0.559325 -1.748607
H -2.963183 -2.093960 1.392002
H 1.960914 1.325444 0.584884
H 4.031819 -2.319048 -0.481907
H 0.196852 0.308036 0.182028
H -3.821887 1.768639 -1.664635
H -5.152664 -0.871843 1.498232
H 4.156808 2.487521 0.848396
H 6.203724 -1.177783 -0.225422
H 8.396040 1.705997 0.515697
H 7.861975 0.054087 1.015064
H 7.816222 0.537161 -0.733746


%chk=000253085-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253085

0 1
O 6.708797 1.433653 0.064806
O -0.799597 -2.624775 0.250644
O -6.305761 2.197199 -0.506293
O -7.184862 0.157104 0.011625
N -6.187064 0.944605 -0.214003
C -2.222912 -0.697673 0.028698
C 2.899078 -0.433434 0.117013
C -0.861136 -1.354312 0.124253
C 1.599668 -1.095547 0.135570
C -2.417173 0.673855 -0.291827
C -3.360875 -1.518604 0.260609
C 3.063632 0.986248 0.035302
C 4.077014 -1.231893 0.183319
C -4.817978 0.374795 -0.131493
C 0.353250 -0.515865 0.079261
C 5.495632 0.747365 0.087232
C -3.713060 1.217839 -0.376508
C -4.661558 -0.993322 0.186332
C 4.334846 1.568728 0.020333
C 5.364664 -0.663109 0.169871
C 7.947763 0.647327 0.130752
H 1.606616 -2.194100 0.203948
H -1.564481 1.327944 -0.493455
H -3.186768 -2.573303 0.494807
H 2.184169 1.636739 -0.015994
H 3.974675 -2.321959 0.246478
H 0.244463 0.571207 0.017993
H -3.883944 2.268067 -0.626224
H -5.546364 -1.609269 0.365864
H 4.468607 2.652769 -0.041535
H 6.243526 -1.311766 0.223076
H 8.757556 1.389878 0.098891
H 8.003920 0.070989 1.073617
H 8.031657 -0.037079 -0.734664


