%chk=000202343.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202343

0 1
O 0.066928 -0.424845 0.079134
N 2.770909 -1.965149 -0.109232
N 4.335086 0.442082 -0.449116
C 2.208300 -0.791233 -0.846372
C 3.387936 -0.036179 -1.509874
C 3.733809 -1.525023 0.951401
C 4.887759 -0.735758 0.299991
C 1.376606 0.199157 0.000523
C 1.691170 -2.822860 0.461418
C 5.443309 1.234541 -1.061298
C -0.936655 0.386162 0.737883
C -1.396106 1.504078 -0.178732
C -2.076236 -0.565874 1.042916
C -1.751239 2.749332 0.356428
C -3.026122 -0.209127 2.011351
C -1.475487 1.288475 -1.561342
C -2.189185 -1.788298 0.367963
C -2.185028 3.773079 -0.491475
C -4.082810 -1.076410 2.300557
C -1.906556 2.314795 -2.405091
C -3.246333 -2.653147 0.664154
C -2.262610 3.558024 -1.871117
C -4.194075 -2.298889 1.629397
H 1.539461 -1.202381 -1.650138
H 3.870512 -0.707848 -2.253608
H 3.006670 0.845220 -2.066167
H 4.143701 -2.431859 1.444675
H 3.254560 -0.907970 1.743009
H 5.564173 -0.353531 1.093333
H 5.484693 -1.416127 -0.345787
H 1.283557 1.184159 -0.485890
H 1.776841 0.330390 1.019432
H 1.141482 -3.287568 -0.373682
H 0.954276 -2.280239 1.079941
H 2.131978 -3.633759 1.058023
H 5.016720 2.116794 -1.565015
H 6.061968 0.686881 -1.787243
H 6.099671 1.609393 -0.259563
H -0.495497 0.788510 1.680380
H -1.693623 2.924731 1.428524
H -2.948144 0.742546 2.532608
H -1.193906 0.313930 -1.963718
H -1.442372 -2.057350 -0.382047
H -2.462837 4.739697 -0.075393
H -4.821647 -0.798679 3.049995
H -1.968441 2.145484 -3.478490
H -3.331830 -3.603327 0.140146
H -2.600693 4.356361 -2.528571
H -5.017641 -2.972092 1.857579


%chk=000202343-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202343

0 1
O -0.018225 -0.592420 -0.111658
N 2.868919 -1.925100 0.035169
N 4.303941 0.495415 -0.559890
C 2.276563 -0.909600 -0.875180
C 3.431408 -0.154757 -1.569186
C 3.796160 -1.343949 1.028110
C 4.899779 -0.533353 0.327496
C 1.283902 0.089986 -0.224508
C 1.927222 -2.903076 0.610680
C 5.326734 1.360091 -1.178258
C -1.025395 0.193302 0.629935
C -1.396707 1.474726 -0.120172
C -2.219136 -0.728965 0.899200
C -1.095945 2.744542 0.426529
C -3.424032 -0.184828 1.412446
C -2.019930 1.401915 -1.392345
C -2.127787 -2.126828 0.694526
C -1.418336 3.928398 -0.277886
C -4.517559 -1.023594 1.719251
C -2.336988 2.579588 -2.101063
C -3.225963 -2.965634 0.994360
C -2.039701 3.848035 -1.544329
C -4.423011 -2.419747 1.510628
H 1.706842 -1.454995 -1.654155
H 4.004095 -0.887979 -2.192163
H 3.023775 0.622911 -2.241264
H 4.261801 -2.173122 1.594487
H 3.278603 -0.686964 1.772384
H 5.528784 -0.030280 1.086061
H 5.549926 -1.238403 -0.252529
H 1.179730 0.994621 -0.857473
H 1.629139 0.416509 0.778749
H 1.297836 -3.322621 -0.194074
H 1.243390 -2.479593 1.383310
H 2.501294 -3.730430 1.069676
H 4.836270 2.142306 -1.785144
H 6.035923 0.801599 -1.841417
H 5.918703 1.859204 -0.389874
H -0.580297 0.489142 1.610191
H -0.605950 2.809284 1.406741
H -3.509566 0.898155 1.561843
H -2.249797 0.418214 -1.817258
H -1.198673 -2.539178 0.293345
H -1.182463 4.906108 0.157264
H -5.442440 -0.589059 2.115526
H -2.818147 2.513472 -3.083595
H -3.145270 -4.045863 0.826123
H -2.290033 4.762613 -2.093840
H -5.272386 -3.071498 1.745033


