%chk=000230594.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230594

0 1
O 5.248225 -1.440325 0.188647
O 5.380668 0.672039 -0.614208
O -3.546770 2.274720 -0.607696
N -1.990440 1.157560 0.633328
C 1.186536 1.097392 0.710016
C 0.249031 2.040841 -0.052919
C 2.502386 0.893982 -0.050642
C -1.062294 2.310993 0.699923
C 3.438117 -0.057440 0.702567
C 4.767907 -0.161916 0.008088
C -3.181312 1.231897 -0.091447
C -3.969364 -0.044412 -0.124595
C 6.564335 -1.769733 -0.357702
C -5.274681 -0.043670 0.383448
C -3.427251 -1.206192 -0.688334
C -6.033204 -1.217234 0.341603
C -4.192677 -2.374922 -0.731748
C 7.649708 -1.199517 0.531277
C -5.492579 -2.381519 -0.213946
H 0.692202 0.120988 0.874286
H 1.392756 1.507078 1.718536
H 0.027814 1.631952 -1.059423
H 0.758280 3.008810 -0.237720
H 3.011808 1.868556 -0.209170
H 2.300746 0.498131 -1.066192
H -1.571576 3.205823 0.259756
H -0.865739 2.548631 1.768810
H 3.612547 0.301064 1.740875
H 2.980049 -1.064233 0.812231
H -1.663138 0.283950 1.027263
H 6.524301 -2.874131 -0.345173
H 6.618994 -1.388208 -1.392880
H -5.696170 0.873078 0.799312
H -2.420485 -1.197716 -1.104091
H -7.048147 -1.221400 0.736802
H -3.777772 -3.279799 -1.172970
H 7.664885 -0.099982 0.483411
H 7.498930 -1.477151 1.582075
H 8.642435 -1.554300 0.230308
H -6.086559 -3.294183 -0.248205


%chk=000230594-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230594

0 1
O 5.238452 -1.509149 -0.098257
O 5.268290 0.731488 -0.753140
O -3.278419 2.138690 -0.822908
N -2.003540 1.237076 0.900003
C 1.107710 1.089813 0.734240
C 0.212130 2.231514 0.206361
C 2.436046 0.971692 -0.044935
C -1.110720 2.406044 0.990781
C 3.317832 -0.184753 0.469509
C 4.684475 -0.226939 -0.196233
C -3.026980 1.171397 -0.034660
C -3.842190 -0.099793 -0.052433
C 6.616275 -1.684580 -0.657081
C -5.128222 -0.040222 -0.647362
C -3.374638 -1.338373 0.461055
C -5.943732 -1.189169 -0.704654
C -4.189342 -2.490569 0.398911
C 7.676081 -1.291461 0.375861
C -5.478408 -2.417612 -0.177917
H 0.555817 0.128827 0.668230
H 1.326953 1.259358 1.810610
H -0.030754 2.060122 -0.859958
H 0.768720 3.189428 0.256626
H 3.003285 1.918650 0.026892
H 2.222160 0.821675 -1.121241
H -1.670184 3.265980 0.583055
H -0.897209 2.602552 2.059346
H 3.487757 -0.072404 1.560693
H 2.827495 -1.165938 0.335663
H -1.890119 0.477667 1.570925
H 6.658823 -2.756549 -0.907883
H 6.702837 -1.073403 -1.572698
H -5.457855 0.917573 -1.063043
H -2.362883 -1.429476 0.875987
H -6.938025 -1.130481 -1.160823
H -3.816266 -3.444061 0.788866
H 7.618380 -0.214005 0.604293
H 7.547431 -1.864487 1.310415
H 8.684831 -1.504773 -0.024152
H -6.109792 -3.311848 -0.225442


