%chk=000209865.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209865

0 1
O 4.111000 -0.327857 -0.912379
N -2.641144 1.107275 -0.414898
C -0.635229 -1.086920 -0.067429
C -1.634733 -0.711250 1.048789
C -2.023307 0.773010 0.910796
C -1.301325 -0.811886 -1.444861
C 0.603346 -0.200353 0.037772
C -0.776646 1.657321 1.137205
C -1.801039 0.639790 -1.556752
C -0.297986 -2.597748 0.024773
C 0.512308 1.093036 0.604121
C 1.827339 -0.641202 -0.473552
C -4.037716 0.586017 -0.510662
C 0.383320 -3.002656 1.328502
C 1.654622 1.904202 0.675758
C 2.948118 0.196297 -0.388254
C 2.888610 1.470562 0.186144
H -1.183744 -0.892685 2.041501
H -2.528814 -1.355310 0.996281
H -2.777730 1.031862 1.698705
H -2.142936 -1.511641 -1.594462
H -0.582013 -1.016988 -2.258732
H -0.666862 1.837668 2.226557
H -0.960809 2.656186 0.682115
H -0.930752 1.334425 -1.613787
H -2.365649 0.774434 -2.502439
H 0.347559 -2.883150 -0.830495
H -1.229809 -3.183469 -0.099775
H 1.935282 -1.621647 -0.935008
H -4.639328 1.009194 0.308907
H -4.125930 -0.509400 -0.478338
H -4.484467 0.940516 -1.453475
H 1.288319 -2.408834 1.513284
H -0.275646 -2.867621 2.193226
H 0.683199 -4.056291 1.304844
H 1.583724 2.898176 1.118313
H 3.763899 2.105888 0.248171
H 4.866569 0.300949 -0.831967


%chk=000209865-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209865

0 1
O 4.212917 -0.315741 -0.916543
N -2.673273 1.082372 -0.422090
C -0.620453 -1.092425 -0.051656
C -1.638994 -0.699213 1.057361
C -2.040875 0.792082 0.902485
C -1.307414 -0.812996 -1.437627
C 0.628145 -0.193530 0.062142
C -0.796408 1.678930 1.150316
C -1.812330 0.649930 -1.557840
C -0.297851 -2.615350 0.030080
C 0.518826 1.122268 0.606531
C 1.878968 -0.626699 -0.440266
C -4.067705 0.601728 -0.518836
C 0.377925 -3.097801 1.332385
C 1.670873 1.944857 0.646012
C 3.011300 0.210265 -0.394744
C 2.918327 1.509571 0.155713
H -1.203439 -0.859849 2.062173
H -2.532849 -1.348963 0.974971
H -2.798909 1.052140 1.666644
H -2.157629 -1.516649 -1.551254
H -0.591887 -1.028002 -2.255892
H -0.690109 1.825856 2.244722
H -0.996250 2.677870 0.717483
H -0.944742 1.332639 -1.616929
H -2.387128 0.778594 -2.493926
H 0.328365 -2.903949 -0.837951
H -1.255857 -3.159537 -0.101862
H 2.002316 -1.623429 -0.873209
H -4.662625 1.041364 0.302675
H -4.196192 -0.507958 -0.472016
H -4.503168 0.947368 -1.473994
H 1.330844 -2.569827 1.513507
H -0.271108 -2.937244 2.212112
H 0.596476 -4.180171 1.275969
H 1.586699 2.955648 1.064776
H 3.795143 2.169040 0.196957
H 4.943673 0.346710 -0.839881


