%chk=000156314.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156314

0 1
 O   -4.749700      -2.394100       1.088300    
 N    3.146900      6.0000003E-04 -0.2489000    
 N   -1.870300       2.973000     -0.7205000    
 N   -2.636000      -3.133100      0.5934000    
 C    1.878900      0.6576000      4.9899999E-02
 C   0.9507000      0.7001000      -1.177800    
 C    2.922000      -1.378800     -0.6830000    
 C    4.028800      2.8700000E-02  0.9189000    
 C  -0.3291000       1.386600     -0.9088000    
 C   -1.530000      0.7864000     -0.4371000    
 C    4.252200      -2.060000     -0.9941000    
 C    4.316000       1.470200       1.331400    
 C   -2.480900       1.803200     -0.3276000    
 C  -0.5697000       2.731200      -1.073400    
 C   -1.900300     -0.5285000     -9.1700003E-02
 C    4.044700      -3.490100      -1.468600    
 C    5.248700       1.527400       2.531500    
 C   -3.788900       1.570000      0.1118000    
 C   -3.205300     -0.7767000      0.3494000    
 C   -4.133400      0.2579000      0.4487000    
 C   -3.595400      -2.131500      0.7081000    
 H    1.365600      0.1713000      0.8908000    
 H    2.022700       1.706400      0.3237000    
 H   0.7006000     -0.3045000      -1.532700    
 H    1.467100       1.199200      -2.008700    
 H    2.372600      -1.952900      7.4500002E-02
 H    2.347400      -1.415000      -1.612700    
 H    3.600900     -0.5310000       1.760700    
 H    5.011900     -0.3941000      0.6981000    
 H    4.893800      -2.149400     -0.1133000    
 H    4.803600      -1.499700      -1.758500    
 H    4.761600       2.027300      0.4986000    
 H    3.415100       2.003500       1.646100    
 H   6.6299997E-02   3.538500      -1.409200    
 H   -2.318000       3.878700     -0.7444000    
 H   -1.138500      -1.290500     -0.1866000    
 H    3.533500      -4.087600     -0.7068000    
 H    3.446000      -3.516400      -2.384800    
 H    5.008400      -3.963800      -1.681300    
 H    4.812100       1.014000       3.394200    
 H    6.211400       1.058700       2.303500    
 H    5.438700       2.567300       2.815900    
 H   -4.511900       2.375100      0.1895000    
 H   -5.148500      6.9499999E-02  0.7913000    
 H   -2.886400      -4.087900      0.8312000    
 H   -1.678800      -3.011600      0.2897000    


%chk=000156314-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000156314

0 1
O -4.828736 -2.513288 0.812241
N 3.029656 -0.143827 0.095806
N -2.013009 3.079207 -0.721004
N -2.670782 -3.247363 0.453577
C 1.713003 0.509579 0.297790
C 1.044243 0.919642 -1.044419
C 2.917897 -1.571644 -0.300398
C 3.968985 0.076909 1.227032
C -0.317297 1.542093 -0.856481
C -1.544283 0.861999 -0.463022
C 4.102676 -2.055380 -1.165230
C 4.636995 1.468836 1.197982
C -2.588287 1.852739 -0.386697
C -0.648110 2.888051 -1.003669
C -1.859020 -0.489443 -0.177033
C 3.973785 -3.544080 -1.554315
C 5.588153 1.683510 2.395479
C -3.915380 1.520312 -0.030831
C -3.183227 -0.836804 0.178831
C -4.194802 0.174099 0.249470
C -3.625301 -2.239577 0.502206
H 1.012444 -0.138520 0.882054
H 1.860518 1.424081 0.899919
H 0.964122 0.026700 -1.696393
H 1.726863 1.619035 -1.560012
H 2.814328 -2.240450 0.593280
H 1.988805 -1.695788 -0.890193
H 3.463143 -0.071243 2.215772
H 4.765105 -0.689321 1.168297
H 5.053344 -1.896994 -0.619104
H 4.153231 -1.420408 -2.069631
H 5.186539 1.569979 0.243073
H 3.860024 2.258585 1.197279
H -0.014194 3.724128 -1.294337
H -2.504347 3.969082 -0.763963
H -1.062061 -1.240287 -0.242495
H 3.938093 -4.191364 -0.657185
H 3.050621 -3.726815 -2.136914
H 4.829576 -3.871565 -2.171785
H 5.045461 1.607011 3.356903
H 6.395088 0.926250 2.405521
H 6.063571 2.680262 2.355267
H -4.703400 2.279062 0.026414
H -5.201646 -0.149480 0.531518
H -2.979826 -4.193048 0.672913
H -1.695460 -3.089261 0.215188


