%chk=000294689.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294689

0 1
O 0.239549 -2.966931 0.201120
O -2.588990 -1.850577 -0.514427
O -3.248280 2.559775 0.510724
O 3.994101 0.670578 -0.787890
O 4.171220 0.621961 1.476870
N -1.070401 1.797239 0.464192
N -2.921055 0.310026 0.060709
N 1.160602 1.069333 0.441561
C -0.645355 -0.608864 0.161842
C -0.166978 0.733883 0.352442
C -2.061554 -0.825965 -0.123400
C -2.489760 1.624255 0.361446
C 0.343606 -1.626772 0.199101
C 1.723481 -1.280675 0.270145
C -0.561439 3.180459 0.689050
C 2.063750 0.056877 0.373848
C -4.388130 0.117059 -0.122012
C 3.510162 0.486955 0.480621
C -1.016694 -3.686609 0.327821
C 5.378362 1.108500 -0.896124
H 2.469826 -2.075298 0.252505
H 0.084696 3.491483 -0.151740
H 0.040462 3.219610 1.615475
H -1.406387 3.888574 0.778790
H -4.856253 -0.164035 0.836338
H -4.573941 -0.689643 -0.856251
H -4.860178 1.048172 -0.484539
H -1.543675 -3.665962 -0.636784
H -1.631920 -3.270986 1.129066
H -0.654654 -4.694131 0.572061
H 6.032311 0.430156 -0.339038
H 5.460226 2.131911 -0.516671
H 5.554591 1.056641 -1.976453


%chk=000294689-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294689

0 1
O 0.259518 -2.793524 -0.379726
O -2.605386 -1.803639 -0.753810
O -3.485300 2.458887 0.911955
O 4.294955 -0.080899 -0.331418
O 3.711322 2.130532 0.121120
N -1.247924 1.845666 0.586645
N -3.012620 0.292221 0.147176
N 0.998873 1.309460 0.274887
C -0.692725 -0.477673 -0.020363
C -0.283697 0.872649 0.274098
C -2.127424 -0.749629 -0.232471
C -2.632938 1.589324 0.583503
C 0.364132 -1.428149 -0.217227
C 1.705368 -0.960704 -0.263426
C -0.793630 3.214688 0.935738
C 1.970293 0.398669 -0.027371
C -4.460866 0.019529 -0.010886
C 3.377304 0.941789 -0.059689
C -0.756530 -3.609979 0.324872
C 5.712944 0.344544 -0.399944
H 2.512882 -1.670021 -0.445372
H -0.232578 3.648926 0.093737
H -0.121355 3.176816 1.806971
H -1.689147 3.810417 1.159892
H -4.728816 -0.892907 0.545516
H -4.698594 -0.144630 -1.074889
H -5.010452 0.887982 0.376531
H -1.684186 -3.644605 -0.262268
H -0.960447 -3.187800 1.326106
H -0.286584 -4.600962 0.415880
H 6.021506 0.797742 0.557086
H 5.850250 1.080820 -1.209640
H 6.273157 -0.578539 -0.602816


