%chk=000150529.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150529

0 1
 O  -1.4500000E-02  -4.230400     -4.9400002E-02
 O    1.522800       1.444200     -0.4402000    
 N   -1.045000       1.200500      2.8899999E-02
 N    2.781100     -0.1378000      0.6958000    
 N    6.094200       1.306700     -0.2035000    
 N   -4.267300      -1.477800     -7.4100003E-02
 C   -1.864900      -1.060800     -2.5599999E-02
 C  -0.8157000     -0.1267000      9.3000000E-03
 C   0.4901000     -0.6093000      2.3399999E-02
 C   -3.174500     -0.5699000     -3.9600000E-02
 C   -3.418100      0.8072000     -1.9400001E-02
 C   -2.308200       1.668100      1.5200000E-02
 C   -1.590900      -2.439400     -4.5400001E-02
 C    3.974800      0.6652000      0.8340000    
 C    4.911700      0.4676000     -0.3485000    
 C   0.7661000      -1.978700      3.8999999E-03
 C    1.620800      0.3121000      5.9599999E-02
 C  -0.2764000      -2.896000     -3.0600000E-02
 C   -4.723700       1.328200     -3.2699998E-02
 C   -2.544300       3.040100      3.5599999E-02
 C   -4.932600       2.704000     -1.1900000E-02
 C   -3.840500       3.561400      2.2299999E-02
 C    6.982900       1.150300      -1.356700    
 C    6.807800      0.9839000       1.033700    
 C   -1.135800      -5.112800     -8.4100001E-02
 H    3.684800       1.717500      0.9330000    
 H    4.419500      0.3401000       1.778800    
 H   -2.409000      -3.143700     -7.2300002E-02
 H    5.179100     -0.5940000     -0.4396000    
 H    4.378900      0.7371000      -1.269700    
 H    1.781200      -2.365500     -2.2299999E-02
 H    2.797100      -1.046100       1.147200    
 H   -5.613000      0.7077000     -5.9200000E-02
 H   -1.704800       3.732600      6.2500000E-02
 H   -4.137300      -2.476900     -8.8200003E-02
 H   -5.221900      -1.153000     -8.4899999E-02
 H   -5.941600       3.104600     -2.2299999E-02
 H   -3.992400       4.636700      3.8800001E-02
 H    6.462100       1.418400      -2.282800    
 H    7.356100      0.1244000      -1.454900    
 H    7.842400       1.825000      -1.275700    
 H    7.009800     -8.8799998E-02   1.134000    
 H    6.270500       1.336400       1.919500    
 H    7.771900       1.506700       1.064300    
 H   -1.718800      -4.989000      -1.003200    
 H   -1.750400      -5.020600      0.8179000    
 H  -0.7406000      -6.134000     -9.4999999E-02


%chk=000150529-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150529

0 1
O -0.706720 -4.893370 -1.210878
O 2.977159 -1.680060 -1.474814
N -0.350852 0.594944 -0.018207
N 2.194464 0.407749 -0.783053
N 5.755950 1.531759 -0.028907
N -4.111316 -1.306504 0.585602
C -1.761874 -1.442776 -0.104160
C -0.499206 -0.742320 -0.291597
C 0.645418 -1.499033 -0.789231
C -2.888192 -0.692864 0.387296
C -2.730014 0.708482 0.672292
C -1.426235 1.304524 0.448387
C -1.857568 -2.843273 -0.407148
C 3.480495 1.081441 -0.993260
C 4.487065 0.791448 0.151638
C 0.502985 -2.853770 -1.068468
C 2.036837 -0.929277 -1.041433
C -0.739643 -3.532598 -0.881862
C -3.791452 1.542028 1.164664
C -1.245100 2.703338 0.725876
C -3.584993 2.896021 1.424935
C -2.295701 3.482958 1.202314
C 6.913177 0.858931 0.593183
C 5.664420 2.949385 0.368566
C -1.941466 -5.661589 -1.047886
H 3.933587 0.730921 -1.937153
H 3.288388 2.166173 -1.079757
H -2.800011 -3.381938 -0.269739
H 4.001409 1.017552 1.135530
H 4.700749 -0.291498 0.129730
H 1.375723 -3.400635 -1.440004
H 1.335366 0.890696 -0.424159
H -4.791814 1.129528 1.346805
H -0.251750 3.127204 0.547498
H -4.248212 -2.292263 0.389795
H -4.908587 -0.782551 0.931621
H -4.406722 3.515297 1.799822
H -2.142347 4.547678 1.409075
H 6.994168 -0.171843 0.206483
H 6.854326 0.807412 1.711079
H 7.842152 1.397261 0.328717
H 5.479592 3.086461 1.466250
H 4.846567 3.451041 -0.177523
H 6.605355 3.469575 0.112979
H -2.748395 -5.267190 -1.696986
H -2.277257 -5.663355 0.008225
H -1.686425 -6.685600 -1.356235


