%chk=000297873.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297873

0 1
O 2.487307 -0.230467 -1.083151
O 3.873886 -1.788344 -1.967969
O 5.631310 2.396519 -0.320929
O -2.249043 0.685275 0.030860
O 1.439293 1.919637 1.448392
O -0.994002 1.334691 -1.776994
N 4.141675 0.870316 0.516089
N 2.607008 3.584803 0.407570
N -0.988391 2.544770 0.233864
C 4.716267 -0.269426 -0.226213
C 5.166379 -1.366822 0.736676
C 3.692505 -0.879675 -1.197124
C 3.865649 3.251898 1.096653
C 4.637716 2.156021 0.341515
C 1.329924 -0.806331 -1.766443
C 0.582572 -1.658579 -0.780539
C 1.452923 2.838454 0.643485
C 0.217387 3.312612 -0.124279
C 0.044588 -2.890252 -1.178455
C 0.407962 -1.210643 0.537894
C -4.185701 -0.628766 -0.132066
C -2.848136 -0.400859 -0.769786
C -0.670938 -3.665924 -0.261194
C -0.302420 -1.993046 1.451088
C -0.844975 -3.219827 1.052691
C -4.305764 -1.536050 0.931209
C -5.315487 0.062849 -0.593470
C -1.345072 1.483935 -0.620950
C -5.553441 -1.758554 1.519867
C -6.560678 -0.163725 -0.000860
C -6.681167 -1.074802 1.053737
H 5.596065 0.094128 -0.841502
H 3.241346 0.707041 0.988428
H 4.349355 -1.730232 1.373300
H 5.566363 -2.233048 0.188679
H 5.960410 -1.001579 1.402273
H 4.510696 4.161107 1.156328
H 3.658115 2.934261 2.148616
H 1.666029 -1.354998 -2.665668
H 0.754287 0.100829 -2.060404
H 2.681998 4.242553 -0.363097
H 0.010687 4.388851 0.101178
H 0.392946 3.247600 -1.231473
H 0.189657 -3.249970 -2.196224
H 0.833636 -0.250326 0.846867
H -2.902957 -0.088303 -1.829157
H -2.152825 -1.257357 -0.668397
H -1.133681 2.403139 1.240743
H -1.086001 -4.623981 -0.570534
H -0.434513 -1.643963 2.474418
H -1.393496 -3.830852 1.766771
H -3.424375 -2.061747 1.299779
H -5.222741 0.779374 -1.408672
H -5.646744 -2.463514 2.344269
H -7.437823 0.372239 -0.360033
H -7.652571 -1.249940 1.513245


%chk=000297873-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297873

0 1
O 2.447201 -0.341891 -1.077059
O 3.901476 -2.078100 -1.648749
O 5.890631 2.399367 0.023079
O -2.552714 1.196586 -0.194453
O 1.429265 1.848279 1.351542
O -0.925986 1.406947 -1.890421
N 4.139486 0.914201 0.467208
N 2.691171 3.602586 0.502058
N -0.902817 2.738405 0.045840
C 4.732468 -0.206244 -0.275009
C 5.530250 -1.168968 0.641282
C 3.677731 -0.991215 -1.071727
C 3.912742 3.229930 1.243661
C 4.749860 2.145705 0.521772
C 1.289972 -1.063448 -1.716160
C 0.591205 -1.939898 -0.696000
C 1.526521 2.873983 0.604886
C 0.356112 3.390973 -0.264280
C 0.365425 -3.312022 -0.964953
C 0.138898 -1.387943 0.532699
C -4.420374 -0.357223 -0.240926
C -3.176737 0.072151 -0.978020
C -0.315262 -4.124547 -0.028703
C -0.529506 -2.203199 1.472302
C -0.763655 -3.571775 1.192973
C -4.393142 -1.492878 0.606652
C -5.632395 0.363783 -0.390506
C -1.409816 1.750480 -0.776030
C -5.557873 -1.900853 1.295086
C -6.796562 -0.039306 0.299410
C -6.761578 -1.174373 1.143815
H 5.441699 0.234181 -1.004610
H 3.187161 0.818562 0.847339
H 4.881794 -1.589554 1.429915
H 5.942678 -2.000035 0.045551
H 6.357084 -0.615831 1.116660
H 4.550254 4.119417 1.360891
H 3.603209 2.864257 2.239037
H 1.669877 -1.651739 -2.568553
H 0.648079 -0.235528 -2.060040
H 2.752909 4.365131 -0.175828
H 0.265205 4.489111 -0.154441
H 0.580886 3.171007 -1.325285
H 0.734633 -3.747271 -1.901002
H 0.331561 -0.332512 0.761003
H -3.390667 0.452156 -1.992660
H -2.432622 -0.740032 -1.049338
H -1.314897 2.832970 0.974647
H -0.481968 -5.185499 -0.246172
H -0.865059 -1.771287 2.422014
H -1.279470 -4.203305 1.925590
H -3.458604 -2.054753 0.724469
H -5.660540 1.242450 -1.046276
H -5.527849 -2.782792 1.944598
H -7.728447 0.523777 0.176633
H -7.665902 -1.491373 1.675490


