%chk=000091643.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091643

0 1
 O    5.008000       1.805900     -6.0000003E-04
 N    1.014600      -1.947800      1.9999999E-04
 N   -4.388000       1.504200      6.9999998E-04
 C   0.2945000      0.1611000     -1.9999999E-04
 C  -0.1189000      -1.169000     -3.0000001E-04
 C    1.725600      0.1648000       0.000000    
 C  -0.6885000       1.172700     -1.9999999E-04
 C   -1.467900      -1.545400     -5.0000002E-04
 C    2.145100      -1.165600      3.0000001E-04
 C   -2.052500      0.8215000     -9.9999997E-05
 C   -2.442300     -0.5323000     -3.0000001E-04
 C    2.704600       1.180600     -1.9999999E-04
 C  -0.2933000       2.620500     -3.0000001E-04
 C   -1.844700      -2.994300     -1.9999999E-04
 C    3.495300      -1.533900      6.0000003E-04
 C   -3.807100     -0.8417000     -1.9999999E-04
 C   -3.065100       1.782600      3.9999999E-04
 C    4.058900      0.8281000      9.9999997E-05
 C    4.446100     -0.5098000      5.0000002E-04
 C   -4.724500      0.1978000      3.0000001E-04
 H    1.027600      -2.957800      3.9999999E-04
 H    2.438600       2.230800      2.2299999E-02
 H   -1.029700       3.291800     -0.4453000    
 H  -7.7000000E-02   2.955000       1.018700    
 H   0.5834000       2.780500     -0.6307000    
 H   -2.429500      -3.236600      0.8937000    
 H   -2.430500      -3.236700     -0.8935000    
 H  -0.9790000      -3.662200     -6.9999998E-04
 H    3.797500      -2.575800      7.9999998E-04
 H   -4.181900      -1.859800     -3.0000001E-04
 H   -2.885000       2.850300      2.7100001E-02
 H    5.502200     -0.7694000      6.9999998E-04
 H   -5.790700     -4.1999999E-03  3.9999999E-04
 H    4.569100       2.673800     -2.4000001E-03


%chk=000091643-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091643

0 1
O 5.131244 1.801418 0.015959
N 1.012333 -1.985048 0.010473
N -4.470739 1.515062 -0.021831
C 0.266463 0.202744 -0.000156
C -0.144202 -1.193338 0.002830
C 1.733604 0.208863 0.006250
C -0.693415 1.232086 -0.008265
C -1.482083 -1.607364 -0.001774
C 2.155286 -1.163992 0.012674
C -2.083487 0.845951 -0.011746
C -2.466905 -0.565077 -0.008133
C 2.720757 1.227349 0.007410
C -0.238150 2.680180 -0.012491
C -1.877787 -3.072283 0.000734
C 3.515240 -1.531979 0.019544
C -3.874346 -0.858145 -0.010826
C -3.156026 1.808657 -0.018762
C 4.083765 0.854737 0.014227
C 4.482526 -0.507434 0.020174
C -4.811909 0.171258 -0.017559
H 1.027472 -3.001144 0.016337
H 2.443101 2.286369 0.003623
H -1.068499 3.399861 -0.024215
H 0.374560 2.898790 0.882906
H 0.390436 2.888146 -0.899364
H -2.469530 -3.331882 0.898947
H -2.495429 -3.327130 -0.880998
H -1.003071 -3.744888 -0.014783
H 3.825664 -2.582063 0.024220
H -4.219514 -1.896282 -0.007036
H -2.928595 2.879697 -0.022120
H 5.551880 -0.736755 0.025297
H -5.886837 -0.039152 -0.019546
H 4.771191 2.722486 0.009198


