%chk=000073392.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073392

0 1
 O    3.131600      -2.702700     -0.8641000    
 O    4.959300      -2.683800      0.5197000    
 N   -3.895900      0.7769000      0.3454000    
 C    1.566200       1.267700     -0.1717000    
 C    2.965700       1.470600      0.4527000    
 C    1.748500      -1.254300      0.3487000    
 C   0.8847000      2.0099999E-02  0.4475000    
 C    3.195600      -1.035300      0.7859000    
 C    3.842600      0.2361000      0.2407000    
 C   0.7204000       2.545400      1.7100001E-02
 C    3.658600       2.716100     -0.1195000    
 C    1.937200      -1.908500      -1.020800    
 C    1.419000       3.783000     -0.5413000    
 C    2.805600       3.966500      6.0800001E-02
 C    3.879300      -2.228700      0.1767000    
 C  -0.4992000     -0.2078000     -8.1299998E-02
 C   0.8236000      -2.853300      -1.446700    
 C   -1.605500     -0.1512000      0.6739000    
 C   -2.995600     -0.3793000      0.1428000    
 C   -3.540000      -1.635900      0.8480000    
 C   -5.292100      0.5166000     -7.3899999E-02
 C   -4.976800      -1.946900      0.4528000    
 C   -5.849500     -0.7167000      0.6565000    
 C   -3.375700       2.008000     -0.2577000    
 C   -5.507700      0.3972000      -1.592000    
 H    1.684400       1.105600      -1.252600    
 H    2.847100       1.620200       1.535600    
 H    1.315300      -2.009200       1.023700    
 H   0.7992000      0.2304000       1.525300    
 H    3.264800      -1.079300       1.878100    
 H    4.814200      0.3796000      0.7312000    
 H    4.066600      0.1252000     -0.8292000    
 H   0.5043000       2.697800       1.082000    
 H  -0.2408000       2.443300     -0.4967000    
 H    3.866600       2.571100      -1.187400    
 H    4.625900       2.866100      0.3747000    
 H    2.127400      -1.178900      -1.815800    
 H   0.8096000       4.671300     -0.3399000    
 H    1.502300       3.693700      -1.631500    
 H    3.302000       4.823000     -0.4089000    
 H    2.713900       4.196400       1.129400    
 H  -0.6057000     -0.3592000      -1.151200    
 H    1.143400      -3.439200      -2.316200    
 H   0.5999000      -3.578400     -0.6564000    
 H  -9.8300003E-02  -2.340300      -1.719000    
 H   -1.509900      4.8599999E-02   1.739300    
 H   -2.933400     -0.5979000     -0.9319000    
 H   -3.497600      -1.506500       1.938900    
 H   -2.910900      -2.504400      0.6128000    
 H   -5.900800       1.366500      0.2644000    
 H   -5.014300      -2.273200     -0.5927000    
 H   -5.357200      -2.777700       1.057700    
 H   -6.871800     -0.9301000      0.3223000    
 H   -5.914000     -0.4989000       1.731000    
 H   -3.118500       1.882400      -1.315000    
 H   -2.485600       2.353600      0.2768000    
 H   -4.103700       2.823200     -0.1731000    
 H   -5.261100       1.332300      -2.105000    
 H   -4.909200     -0.4008000      -2.040800    
 H   -6.559800      0.1829000      -1.811100    


%chk=000073392-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000073392

0 1
O 3.085146 -2.802908 -0.658975
O 4.925278 -2.797863 0.761159
N -4.000293 0.656476 0.440666
C 1.664408 1.340746 -0.235392
C 3.064736 1.517395 0.413408
C 1.702922 -1.170837 0.473187
C 0.889847 0.165397 0.440417
C 3.181623 -1.002142 0.918224
C 3.891872 0.223584 0.272593
C 0.851414 2.658873 -0.156646
C 3.822493 2.724781 -0.193002
C 1.831189 -1.977877 -0.853310
C 1.615895 3.854025 -0.769201
C 3.000431 4.030356 -0.105077
C 3.856310 -2.276249 0.403157
C -0.492667 -0.025553 -0.158673
C 0.712078 -2.966771 -1.174749
C -1.644607 -0.085723 0.555271
C -3.021040 -0.373500 -0.015413
C -3.463524 -1.783913 0.471555
C -5.423449 0.390429 0.057308
C -4.920174 -2.115173 0.085712
C -5.855756 -0.996644 0.591297
C -3.577930 2.040952 0.143865
C -5.730936 0.546246 -1.462950
H 1.820282 1.099486 -1.312591
H 2.907567 1.722126 1.497382
H 1.197550 -1.840966 1.198435
H 0.753448 0.451972 1.506808
H 3.281294 -0.941259 2.015641
H 4.887004 0.343417 0.740921
H 4.073150 0.033307 -0.805500
H 0.627549 2.875508 0.910220
H -0.125503 2.529006 -0.660055
H 4.051872 2.508119 -1.258127
H 4.796347 2.846516 0.321758
H 2.032963 -1.311547 -1.714961
H 1.017972 4.779954 -0.664013
H 1.752977 3.683528 -1.857502
H 3.554238 4.862296 -0.581465
H 2.861625 4.306083 0.960936
H -0.541209 -0.116349 -1.256947
H 0.973331 -3.564518 -2.064932
H 0.556675 -3.657728 -0.327533
H -0.235472 -2.436721 -1.368367
H -1.617917 0.032191 1.650848
H -2.938696 -0.394846 -1.134934
H -3.365721 -1.811418 1.575082
H -2.762757 -2.533854 0.057760
H -6.023220 1.156221 0.591537
H -5.007353 -2.222968 -1.013727
H -5.214596 -3.088605 0.522189
H -6.903036 -1.193437 0.291817
H -5.822659 -0.970590 1.697790
H -3.443059 2.254889 -0.945492
H -2.617768 2.256576 0.643081
H -4.336065 2.742505 0.537702
H -5.482009 1.561138 -1.821763
H -5.170935 -0.178406 -2.080506
H -6.808938 0.383270 -1.646920


