%chk=000228486.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228486

0 1
O -1.503860 1.663004 -0.770577
O -1.281545 -1.908643 -0.492239
O 3.218386 1.587482 0.423005
O -1.762932 0.723469 1.273253
O 0.483706 -2.194742 0.905373
N 1.198957 0.513369 0.665270
C 0.566050 0.214953 -1.652702
C 0.100319 -0.007484 -0.161399
C 1.800078 1.137593 -1.540491
C 2.221969 1.133784 -0.086028
C 0.897987 -1.088714 -2.364893
C -1.160800 0.801754 0.231826
C -0.165904 -1.489047 0.178410
C -2.641123 2.565563 -0.539859
C -1.792078 -3.256166 -0.202067
C -2.216097 3.702394 0.361827
C -2.486640 -3.256331 1.140533
H -0.251046 0.735526 -2.212474
H 1.565393 2.171153 -1.863188
H 2.638660 0.808390 -2.183187
H 1.289118 0.233544 1.638597
H 1.680149 -1.663231 -1.851191
H 0.013108 -1.736025 -2.457650
H 1.257356 -0.900399 -3.384955
H -2.857881 2.881255 -1.576745
H -3.474882 1.973849 -0.122191
H -2.481297 -3.394436 -1.055403
H -0.947660 -3.965603 -0.252001
H -2.994038 4.472445 0.432206
H -2.012632 3.347820 1.384656
H -1.298516 4.186815 0.002620
H -3.057080 -4.178885 1.300737
H -1.766299 -3.165973 1.968411
H -3.183626 -2.411182 1.236115


%chk=000228486-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228486

0 1
O -1.449473 1.754188 -0.769791
O -1.340915 -2.001663 -0.511446
O 3.117623 1.805389 0.207791
O -1.821620 0.568924 1.203664
O 0.452957 -2.215134 0.970125
N 1.225543 0.430588 0.504907
C 0.543624 0.080755 -1.749647
C 0.076427 -0.086737 -0.247340
C 1.516799 1.289311 -1.664176
C 2.088093 1.237720 -0.237367
C 1.264719 -1.176601 -2.283849
C -1.177893 0.749243 0.145343
C -0.219920 -1.545624 0.159668
C -2.560479 2.701788 -0.413359
C -1.836977 -3.369983 -0.143319
C -2.038614 3.827067 0.481918
C -2.734738 -3.292437 1.093053
H -0.332120 0.304008 -2.377497
H 0.986373 2.249028 -1.798363
H 2.336593 1.240154 -2.398338
H 1.393317 0.176254 1.480257
H 2.127086 -1.451049 -1.648524
H 0.582606 -2.042625 -2.340447
H 1.644346 -0.979906 -3.302368
H -2.903738 3.069546 -1.393145
H -3.359331 2.123781 0.082622
H -2.385781 -3.692404 -1.042105
H -0.961958 -4.021496 0.027041
H -2.848637 4.556280 0.668362
H -1.702167 3.432374 1.454918
H -1.199833 4.359900 0.002127
H -3.155247 -4.292520 1.306868
H -2.162388 -2.961421 1.975167
H -3.568979 -2.589398 0.930850


