%chk=000242436.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242436

0 1
O -0.650898 -1.553691 -1.501877
O -3.488506 -0.892088 -1.322374
O -4.271997 0.704545 0.984060
O 5.110721 -2.058722 0.105848
O 2.802471 3.703106 -0.835241
N 1.160666 2.209492 -0.311372
C 1.921334 1.628897 0.825753
C 1.190048 1.887257 2.163918
C 0.277280 0.755700 2.650111
C 2.190077 0.154959 0.555041
C -0.708020 0.338685 1.594547
C -0.262345 -0.417151 0.491890
C 1.160523 -0.791078 0.377551
C -1.206842 -0.825875 -0.486432
C 3.531215 -0.245306 0.466709
C -2.048239 0.725834 1.702198
C 1.492512 -2.135661 0.108231
C -2.568964 -0.475317 -0.361785
C -2.969897 0.329770 0.726442
C 3.822210 -1.588062 0.203611
C 2.815609 -2.550954 0.021790
C 1.713384 3.220020 -1.102534
C 0.861301 3.659970 -2.260724
C -1.456684 -1.879805 -2.665353
C -4.339260 -1.975861 -0.841679
C -5.022299 1.263547 -0.128806
H 2.908984 2.183687 0.874165
H 0.603779 2.826338 2.078876
H 1.952456 2.085503 2.944611
H -0.244169 1.077911 3.574786
H 0.891357 -0.122174 2.952938
H 0.276020 1.766659 -0.543368
H 4.330826 0.480583 0.587146
H -2.394327 1.332963 2.536570
H 0.688235 -2.859674 -0.044900
H 3.084221 -3.583824 -0.184426
H -0.124973 4.020822 -1.943655
H 1.355795 4.489242 -2.792677
H 0.709778 2.853922 -2.990622
H 5.778435 -1.338020 0.213923
H -1.986570 -0.995825 -3.035376
H -2.159699 -2.675933 -2.407759
H -0.690324 -2.222888 -3.370952
H -3.730449 -2.852032 -0.605956
H -4.993416 -2.156144 -1.699813
H -4.905576 -1.645394 0.035609
H -4.659754 2.279225 -0.310804
H -6.044836 1.268240 0.264387
H -4.936395 0.644799 -1.029427


%chk=000242436-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242436

0 1
O -1.018223 -1.762955 -1.345643
O -3.696662 -0.927158 -1.097637
O -4.416500 0.831788 1.112652
O 5.082523 -2.192899 0.117700
O 2.847371 3.124256 -1.442996
N 1.044026 2.153924 -0.330452
C 1.871890 1.592177 0.762102
C 1.272096 1.930602 2.161411
C 0.263397 0.881522 2.706716
C 2.131037 0.091200 0.568101
C -0.766882 0.429036 1.684245
C -0.362748 -0.431921 0.612012
C 1.064049 -0.856128 0.474244
C -1.362552 -0.866294 -0.303907
C 3.469741 -0.344940 0.448535
C -2.108774 0.854104 1.782853
C 1.392004 -2.222755 0.258588
C -2.722751 -0.465810 -0.179315
C -3.094853 0.425321 0.863702
C 3.767892 -1.711857 0.244420
C 2.724648 -2.658980 0.150617
C 1.603691 2.871645 -1.375439
C 0.620846 3.350793 -2.441872
C -0.981476 -1.141551 -2.688901
C -4.019549 -2.369728 -0.960850
C -5.180851 1.405416 -0.017443
H 2.835975 2.121986 0.661663
H 0.795748 2.927225 2.091100
H 2.102040 2.019001 2.888689
H -0.243165 1.303404 3.593762
H 0.836592 -0.001550 3.048697
H 0.045019 1.941385 -0.335064
H 4.278784 0.396804 0.489068
H -2.425607 1.513813 2.597098
H 0.582237 -2.951788 0.173084
H 2.971324 -3.712156 -0.010666
H -0.420987 3.036411 -2.254926
H 0.657372 4.452577 -2.496899
H 0.942514 2.965127 -3.424745
H 5.735429 -1.451057 0.167935
H -0.200045 -0.358419 -2.722903
H -1.969651 -0.717110 -2.944225
H -0.722855 -1.954814 -3.383855
H -3.115930 -2.980245 -1.132541
H -4.776102 -2.575359 -1.733685
H -4.437245 -2.570694 0.043087
H -4.711936 2.352366 -0.349031
H -6.181965 1.609604 0.391548
H -5.236136 0.694882 -0.857832


