%chk=000124787.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124787

0 1
 O    2.070800      0.3928000      0.5688000    
 O   -1.980400       2.259400     -0.1950000    
 O    1.210300     -0.8715000      -1.144700    
 N   -3.721000      0.7970000      2.7899999E-02
 N  -0.1626000      0.2859000      0.3255000    
 C   -1.435000     -9.1799997E-02 -0.2326000    
 C   -1.947000      -1.376100      0.4048000    
 C   -3.363100      -1.653300     -7.3200002E-02
 C   -4.263300     -0.5091000      0.3535000    
 C   -2.379500       1.097300     -9.5399998E-02
 C    3.395700      3.7099998E-02  0.1579000    
 C    1.054100     -0.1349000     -0.1763000    
 C    3.605700      0.5191000      -1.276800    
 C    4.372800      0.7292000       1.105900    
 C    3.542400      -1.481100      0.2496000    
 H   -1.304500     -0.2586000      -1.309900    
 H   -1.933100      -1.295800       1.499700    
 H   -1.292800      -2.215900      0.1422000    
 H   -3.373200      -1.753200      -1.165400    
 H   -3.731300      -2.596400      0.3446000    
 H   -5.246200     -0.5898000     -0.1213000    
 H   -4.413100     -0.5251000       1.438700    
 H   -4.365100       1.581300      6.1900001E-02
 H  -0.1510000      0.8833000       1.147200    
 H    3.225600       1.538900      -1.408200    
 H    4.674000      0.5252000      -1.525000    
 H    3.131700     -0.1029000      -2.040100    
 H    4.191700      0.4219000       2.142300    
 H    4.237200       1.816500       1.077200    
 H    5.414300      0.5034000      0.8548000    
 H    3.055000      -2.035200     -0.5564000    
 H    4.600300      -1.766300      0.2067000    
 H    3.131500      -1.857900       1.193500    


%chk=000124787-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124787

0 1
O 2.095247 0.450163 0.453368
O -2.097117 2.280588 0.726591
O 0.994316 -1.134942 -0.939286
N -3.811910 0.758421 0.384396
N -0.165415 0.426909 0.362120
C -1.485341 0.065650 -0.154861
C -1.945208 -1.368306 0.204202
C -3.357046 -1.582880 -0.377998
C -4.368498 -0.610414 0.260972
C -2.482299 1.124213 0.361114
C 3.497696 -0.018470 0.096210
C 0.976953 -0.172134 -0.118139
C 3.738174 0.189359 -1.413097
C 4.370685 0.925074 0.941986
C 3.675812 -1.488922 0.525483
H -1.476911 0.134748 -1.265671
H -1.946915 -1.495195 1.304154
H -1.224065 -2.086001 -0.220611
H -3.327555 -1.431035 -1.474376
H -3.702377 -2.617551 -0.203054
H -5.295520 -0.565952 -0.340953
H -4.645897 -0.976148 1.271819
H -4.442008 1.498738 0.708768
H -0.099799 1.307678 0.883870
H 3.543776 1.240341 -1.692277
H 4.791720 -0.042373 -1.655049
H 3.083421 -0.466967 -2.007528
H 4.152964 0.796019 2.016206
H 4.177514 1.977443 0.671792
H 5.439621 0.705905 0.768757
H 3.026977 -2.151292 -0.068501
H 4.728820 -1.790459 0.376025
H 3.431085 -1.608809 1.595963


