%chk=000288950.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288950

0 1
O -1.917048 1.364803 1.452947
N -4.242232 -0.507896 -0.733890
C -3.877571 0.953434 -0.534790
C -2.365494 0.611304 -0.760883
C -2.785651 -0.877693 -0.891168
C -5.016466 -1.184844 0.357923
C -4.508601 1.845598 -1.586425
C -1.470198 0.907003 0.419055
C -4.330383 -1.109326 1.737896
C -6.394021 -0.496009 0.424551
C -5.186878 -2.659324 -0.058793
C -0.009923 0.622634 0.275687
C 0.525564 -0.065158 -0.822721
C 0.847816 1.064212 1.297906
C 1.897808 -0.305317 -0.901688
C 2.219850 0.826328 1.223143
C 2.752766 0.139680 0.120472
C 4.208357 -0.115852 0.035160
C 4.861826 -0.812440 1.063936
C 4.939058 0.337882 -1.074249
C 6.235351 -1.054246 0.979282
C 6.313275 0.096979 -1.150031
C 6.962630 -0.599651 -0.125619
H -4.071037 1.347463 0.489715
H -1.952196 1.049389 -1.687289
H -2.613443 -1.317398 -1.887231
H -2.364407 -1.548928 -0.128596
H -4.087151 2.855657 -1.557356
H -4.370719 1.443495 -2.598899
H -5.592508 1.922441 -1.430198
H -3.429595 -1.727470 1.784622
H -4.998721 -1.452716 2.532562
H -4.026213 -0.083620 1.988959
H -6.850672 -0.439642 -0.571554
H -6.321948 0.525697 0.809926
H -7.079628 -1.046818 1.074679
H -5.642181 -2.731356 -1.054543
H -5.831145 -3.194827 0.644224
H -4.230534 -3.187775 -0.101751
H -0.124318 -0.421713 -1.622684
H 0.422534 1.596414 2.155380
H 2.309055 -0.845310 -1.753808
H 2.879544 1.177661 2.016002
H 4.296126 -1.169052 1.923704
H 4.435349 0.883693 -1.870762
H 6.740060 -1.597900 1.776619
H 6.879394 0.453251 -2.009410
H 8.033018 -0.787538 -0.188010


%chk=000288950-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288950

0 1
O -1.754613 1.501518 1.673773
N -4.201321 -0.534587 -0.570651
C -3.827487 0.912249 -0.283844
C -2.324651 0.533379 -0.483472
C -2.771573 -0.979130 -0.436979
C -5.276183 -1.238028 0.203787
C -4.412066 1.955847 -1.238263
C -1.345526 0.956097 0.602438
C -5.016928 -1.275170 1.741986
C -6.611335 -0.504135 -0.072206
C -5.351494 -2.683799 -0.346512
C 0.115629 0.679410 0.398162
C 0.618927 -0.000624 -0.744089
C 1.038949 1.106026 1.391661
C 1.997888 -0.243580 -0.885552
C 2.415105 0.868410 1.245313
C 2.927050 0.187410 0.102641
C 4.386409 -0.068227 -0.051873
C 5.212819 -0.296693 1.083756
C 4.993170 -0.091710 -1.338957
C 6.594510 -0.541692 0.938286
C 6.375001 -0.334997 -1.485635
C 7.183611 -0.562129 -0.347505
H -3.995941 1.209494 0.772620
H -1.957238 0.816676 -1.484548
H -2.408164 -1.620486 -1.260227
H -2.515421 -1.457933 0.533365
H -3.939943 2.941234 -1.061620
H -4.238929 1.659232 -2.288628
H -5.500923 2.071301 -1.092752
H -4.105073 -1.848780 1.990956
H -5.865752 -1.759804 2.258310
H -4.904964 -0.257435 2.157991
H -6.783894 -0.423410 -1.159955
H -6.604769 0.514285 0.357396
H -7.453600 -1.056554 0.382751
H -5.569036 -2.668078 -1.429119
H -6.144507 -3.256084 0.168715
H -4.395625 -3.219593 -0.194420
H -0.066396 -0.358647 -1.519322
H 0.644616 1.632646 2.267132
H 2.358371 -0.801376 -1.756783
H 3.109061 1.238682 2.007853
H 4.766001 -0.315292 2.084196
H 4.385884 0.114364 -2.227703
H 7.209651 -0.725323 1.826196
H 6.822564 -0.338208 -2.485747
H 8.256637 -0.751553 -0.460919


