%chk=000071492.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071492

1 1
 O   -5.374100       1.754800      0.3328000    
 O  -0.1185000     -0.5078000      0.8584000    
 O   0.3492000       1.741700      0.9524000    
 O    2.474100      9.3400002E-02   2.238700    
 N   -3.839700     -0.7207000     -0.9305000    
 C   -3.381100      0.7252000     -0.6058000    
 C   -3.789000      -1.340300      0.4795000    
 C   -4.174300       1.070100      0.6712000    
 C   -4.484500     -0.2743000       1.345300    
 C   -1.873600      0.7114000     -0.2887000    
 C   -2.321900      -1.521700      0.9091000    
 C   -1.511900     -0.2162000      0.8816000    
 C   -5.269300     -0.7528000      -1.504500    
 C   -2.988300      -1.439800      -1.978400    
 C   -5.103400       3.001600     -0.2924000    
 C   0.7236000      0.5762000      0.8990000    
 C    2.185700      0.1288000      0.8261000    
 C    3.107900       1.127400      0.1223000    
 C    2.345400      -1.272900      0.2330000    
 C    2.633100       1.796800     -0.9820000    
 C    2.073000      -1.458000      -1.102800    
 C    4.376000       1.317000      0.6209000    
 C    2.754900      -2.294700       1.058700    
 C    3.473600       2.706700      -1.623400    
 C    2.218500      -2.735800      -1.643200    
 C    5.216400       2.227100     -2.0400001E-02
 C    2.900600      -3.572300      0.5183000    
 C    4.765200       2.922000      -1.142500    
 C    2.632300      -3.793000     -0.8327000    
 H   -3.581100       1.327500      -1.493800    
 H   -4.324000      -2.295700      0.4650000    
 H   -3.606900       1.709200       1.358800    
 H   -5.564400     -0.4556000       1.393400    
 H   -4.119200     -0.2979000       2.378200    
 H   -1.285300      0.4680000      -1.181200    
 H   -1.614200       1.750300     -5.9999999E-02
 H   -2.288800      -1.928900       1.928500    
 H   -1.830400      -2.289400      0.3000000    
 H   -1.715600      0.3092000       1.824600    
 H   -5.535000      -1.797500      -1.693900    
 H   -5.272700     -0.1786000      -2.435600    
 H   -5.981700     -0.3258000     -0.7995000    
 H   -3.375400      -2.457200      -2.090100    
 H   -1.942000      -1.485500      -1.677900    
 H   -3.073600     -0.8880000      -2.919500    
 H   -5.985300       3.635900     -0.1599000    
 H   -4.248100       3.516000      0.1576000    
 H   -4.959700       2.878300      -1.368600    
 H    1.825700     -0.4804000       2.682900    
 H    1.635000       1.646200      -1.379800    
 H    1.724700     -0.6626000      -1.750800    
 H    4.749600      0.7774000       1.485200    
 H    2.987400      -2.170000       2.110000    
 H    3.123000       3.247000      -2.497900    
 H    2.003400      -2.909100      -2.693600    
 H    6.223200       2.392600      0.3520000    
 H    3.225100      -4.395400       1.148200    
 H    5.419900       3.629700      -1.642500    
 H    2.744500      -4.788000      -1.253200    


%chk=000071492-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071492

1 1
O -5.423623 1.796860 -0.590430
O -0.163073 -0.434999 0.791155
O 0.561426 1.477096 -0.319584
O 2.258929 -1.117327 1.563320
N -4.259601 -1.085491 0.170361
C -3.639454 0.010055 -0.757534
C -3.874706 -0.489189 1.570800
C -4.130008 1.341667 -0.092507
C -4.304380 0.993409 1.417814
C -2.102475 -0.092661 -0.725911
C -2.354504 -0.638268 1.798237
C -1.542992 0.101935 0.710928
C -5.784234 -1.142066 0.009789
C -3.739977 -2.492669 -0.078528
C -5.350883 2.594662 -1.828458
C 0.844085 0.396052 0.229701
C 2.239054 -0.274109 0.362061
C 3.310510 0.814354 0.574445
C 2.491244 -1.133238 -0.903154
C 3.855268 1.516284 -0.526518
C 1.902020 -0.850615 -2.160579
C 3.725068 1.140266 1.888719
C 3.387117 -2.226110 -0.786098
C 4.808256 2.536505 -0.315552
C 2.197142 -1.657877 -3.283552
C 4.683093 2.157532 2.095377
C 3.680326 -3.029032 -1.908962
C 5.224964 2.861168 0.995732
C 3.084268 -2.750387 -3.161374
H -4.043664 -0.131229 -1.774352
H -4.447430 -1.036319 2.337893
H -3.366682 2.127650 -0.258760
H -5.359210 1.154787 1.691550
H -3.696067 1.642439 2.066614
H -1.749668 -1.052833 -1.141371
H -1.691700 0.696653 -1.379345
H -2.120352 -0.211705 2.789543
H -2.051493 -1.697755 1.847193
H -1.487975 1.184499 0.932091
H -6.196909 -1.745055 0.833858
H -6.012132 -1.623197 -0.954282
H -6.202863 -0.127165 0.009195
H -4.237596 -3.176366 0.627237
H -2.655609 -2.552864 0.058818
H -3.993067 -2.782457 -1.110369
H -6.382553 2.912062 -2.037555
H -4.710775 3.485628 -1.680658
H -4.968237 1.999973 -2.682171
H 1.538556 -1.793987 1.483781
H 3.551065 1.264370 -1.547297
H 1.237140 0.013093 -2.281526
H 3.316576 0.579945 2.733637
H 3.854602 -2.428879 0.182499
H 5.229596 3.071550 -1.173356
H 1.746415 -1.424511 -4.254608
H 5.008534 2.397236 3.113574
H 4.380224 -3.865687 -1.809637
H 5.968662 3.648961 1.157761
H 3.317752 -3.371038 -4.033053


