%chk=000177357.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177357

0 1
 O   -4.916100       2.008100      0.2354000    
 O   -5.596500      -1.868200       1.342800    
 O    3.471600      0.1570000     -0.2241000    
 O   -4.015300       2.541300      -1.813600    
 O    3.701400      -1.270000       1.605900    
 N   -5.677100     -0.3879000     -0.4568000    
 N    9.855200       1.219500      3.7400000E-02
 N    9.719400     -0.6314000      -1.382700    
 C   -5.017200      0.3817000      -1.510600    
 C   -7.122100     -0.2229000     -0.3760000    
 C   -5.034500      -1.230700      0.4508000    
 C   -3.554400      -1.362600      0.3200000    
 C   -1.251900     -0.5611000      0.9391000    
 C   -2.720500     -0.5389000      0.9801000    
 C   -3.085000      -2.433100     -0.6153000    
 C  -0.5595000      -1.693300       1.368700    
 C  -0.5499000      0.5497000      0.4711000    
 C   -4.590400       1.759900      -1.062900    
 C    1.536400     -0.6038000      0.8623000    
 C   -7.779300      -1.252600      -1.233600    
 C   0.8346000      -1.714700       1.330300    
 C   0.8441000      0.5285000      0.4327000    
 C    2.989900     -0.6269000      0.8218000    
 C   -4.542500       3.296800      0.7347000    
 C    4.865300      0.1818000     -0.3241000    
 C   -8.600500     -0.9632000      -2.249500    
 C    7.647100      0.2339000     -0.5276000    
 C    5.596500       1.152600      0.3605000    
 C    5.524900     -0.7627000      -1.110600    
 C    6.987300       1.178600      0.2588000    
 C    6.915800     -0.7366000      -1.212300    
 C   -4.974100       3.409100       2.181300    
 C    9.097200      0.2618000     -0.6339000    
 H   -4.121900     -0.1434000      -1.851900    
 H   -5.699500      0.4858000      -2.360700    
 H   -7.448800     -0.3702000      0.6596000    
 H   -7.392700      0.8007000     -0.6594000    
 H   -3.136700      0.2411000       1.614800    
 H   -3.804700      -2.587300      -1.427000    
 H   -2.981200      -3.382900     -8.0700003E-02
 H   -2.130000      -2.190200      -1.091200    
 H   -1.088000      -2.566600       1.743400    
 H   -1.076800       1.439900      0.1353000    
 H   -7.590700      -2.298600      -1.004300    
 H    1.358500      -2.605400       1.667300    
 H    1.363900       1.413500      7.5300001E-02
 H   -5.033400       4.075100      0.1400000    
 H   -3.455400       3.414000      0.6628000    
 H   -9.055400      -1.757100      -2.831600    
 H   -8.831000      6.1900001E-02  -2.517700    
 H    5.087100       1.891200      0.9735000    
 H    4.960000      -1.520400      -1.646700    
 H    7.506400       1.954000      0.8110000    
 H    7.397700      -1.486700      -1.833300    
 H   -4.703400       4.384100       2.596100    
 H   -4.504900       2.625000       2.784700    
 H   -6.057000       3.274000       2.271700    
 H    10.86610       1.223500     -5.0700001E-02
 H    9.459900       1.938500      0.6303000    
 H    10.72770     -0.4483000      -1.331700    


%chk=000177357-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177357

0 1
O -4.482559 1.843262 -0.871493
O -5.907921 -1.426439 2.105526
O 3.589278 0.003867 0.279441
O -4.858439 1.290953 -3.103553
O 3.556967 -2.343749 0.056010
N -5.806036 -0.448549 -0.000388
N 10.078063 0.482370 -0.357594
N 9.439129 2.641804 0.532227
C -5.304458 -0.400073 -1.374666
C -7.159378 0.139572 0.214852
C -5.239694 -1.180898 1.047283
C -3.807053 -1.663524 0.938090
C -1.376098 -0.943804 0.474774
C -2.836275 -0.766823 0.556562
C -3.582487 -3.060622 1.480397
C -0.718452 -2.199991 0.301578
C -0.561605 0.229018 0.524719
C -4.876408 0.982069 -1.891195
C 1.476578 -1.100830 0.291774
C -8.258339 -0.736116 -0.357085
C 0.681449 -2.274857 0.212371
C 0.838584 0.158942 0.445224
C 2.952979 -1.253932 0.194595
C -4.024975 3.206379 -1.303601
C 4.997175 0.219470 0.229807
C -9.079807 -0.369192 -1.372311
C 7.724516 0.971677 0.159699
C 5.988204 -0.787657 0.167707
C 5.352504 1.588982 0.270020
C 7.344680 -0.393698 0.135349
C 6.706253 1.958410 0.236045
C -3.651122 3.967302 -0.036747
C 9.155277 1.420626 0.119203
H -4.440160 -1.077209 -1.484872
H -6.087091 -0.753143 -2.073997
H -7.287538 0.242139 1.306184
H -7.177469 1.145020 -0.244971
H -3.177010 0.253243 0.325826
H -4.381750 -3.291376 2.204299
H -2.608719 -3.156032 1.989042
H -3.624391 -3.824802 0.678280
H -1.305835 -3.115343 0.200148
H -1.048153 1.204877 0.643236
H -8.362168 -1.724416 0.112603
H 1.185394 -3.236941 0.072972
H 1.448178 1.064454 0.497924
H -4.851930 3.683699 -1.859248
H -3.173755 3.078519 -1.996130
H -9.867358 -1.034105 -1.743967
H -8.997984 0.614761 -1.852605
H 5.709147 -1.840853 0.150156
H 4.559572 2.340546 0.327196
H 8.103116 -1.185158 0.134133
H 7.014914 3.006859 0.277353
H -3.316414 4.986921 -0.300610
H -2.830467 3.464365 0.503777
H -4.514792 4.050415 0.644428
H 11.071148 0.704536 -0.367575
H 9.779125 -0.375222 -0.815792
H 10.447560 2.885196 0.446588


