%chk=000124784.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124784

0 1
 O   -2.927100       2.280000      0.5112000    
 O   -2.250400       1.316300      -1.425000    
 N   -2.434500      -1.160300     -0.2427000    
 N    4.181600     -0.2619000     -1.0100000E-02
 C  -0.7001000     -3.7000000E-02   1.121400    
 C   0.3797000     -5.2000001E-02  3.0900000E-02
 C   -2.141000      2.0000001E-03  0.5968000    
 C    1.804000     -0.1628000      0.5807000    
 C    2.832100     -0.1477000     -0.5505000    
 C   -2.441900       1.244000     -0.2164000    
 C   -3.840100      -1.156800     -0.6451000    
 C   -2.107700      -2.396800      0.4658000    
 C    4.479700      0.8658000      0.8745000    
 C    5.165800     -0.3326000      -1.091500    
 H  -0.5405000      0.8684000       1.723900    
 H  -0.5471000     -0.8670000       1.820700    
 H   0.3052000      0.8667000     -0.5635000    
 H   0.2097000     -0.8861000     -0.6592000    
 H   -2.817600      8.1000002E-03   1.463500    
 H    1.900100      -1.085300       1.166600    
 H    1.942700      0.6795000       1.266200    
 H    2.718700      0.7649000      -1.150400    
 H    2.629200     -0.9980000      -1.214000    
 H   -4.516300      -1.161400      0.2182000    
 H   -4.062300      -2.049000      -1.243200    
 H   -4.107200     -0.3121000      -1.286700    
 H   -1.029300      -2.548500      0.5703000    
 H   -2.453700      -3.265400     -0.1083000    
 H   -2.577600      -2.449700       1.454900    
 H    4.264400       1.833900      0.4079000    
 H    5.541000      0.8613000       1.152200    
 H    3.942800      0.7940000       1.825000    
 H    5.166100      0.5725000      -1.709800    
 H    4.965000      -1.193300      -1.739400    
 H    6.174100     -0.4756000     -0.6871000    
 H   -3.102500       3.068200     -4.5800000E-02


%chk=000124784-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124784

0 1
O -2.751065 2.309417 0.686454
O -2.498357 1.420543 -1.439607
N -2.487423 -1.244868 -0.221116
N 4.198297 -0.200177 -0.003738
C -0.761554 0.055881 1.118195
C 0.314912 0.017262 0.012561
C -2.231321 -0.035481 0.591656
C 1.744705 -0.019932 0.598114
C 2.820133 0.023179 -0.506756
C -2.508417 1.244126 -0.204628
C -3.877393 -1.310900 -0.727676
C -2.108554 -2.496936 0.466646
C 4.681650 0.885319 0.873105
C 5.146100 -0.466503 -1.105739
H -0.677948 0.993263 1.700345
H -0.596751 -0.769394 1.836674
H 0.204954 0.903000 -0.645185
H 0.142833 -0.862194 -0.637009
H -2.900592 0.008658 1.491184
H 1.893110 -0.945213 1.189543
H 1.872588 0.832322 1.295877
H 2.736971 0.995913 -1.063271
H 2.601515 -0.779936 -1.237887
H -4.641320 -1.357839 0.090240
H -3.991001 -2.213222 -1.353307
H -4.089869 -0.436649 -1.362896
H -1.022673 -2.532970 0.654217
H -2.359428 -3.348657 -0.189293
H -2.637288 -2.648608 1.442715
H 4.724389 1.880442 0.357589
H 5.698267 0.642760 1.231457
H 4.029459 0.985483 1.756898
H 5.271620 0.399535 -1.806326
H 4.797714 -1.333321 -1.695521
H 6.140320 -0.713185 -0.690808
H -2.873583 3.145181 0.159292


