%chk=000153588.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153588

0 1
 O   -4.130000      -3.453900     -0.4918000    
 N   -3.056400       1.830100      0.4894000    
 N    2.852700      8.3800003E-02 -0.9229000    
 N    3.257500       2.360200     -0.4892000    
 N    4.089200      -1.926000       1.614800    
 C   -1.275100      0.6214000     -8.6800002E-02
 C   -1.700600       1.898800      0.2696000    
 C  -0.8297000       2.992000      0.3604000    
 C   0.9895000       1.502700     -0.2848000    
 C   -2.424500     -0.2313000     -7.5999998E-02
 C   0.5316000       2.784600      7.8199998E-02
 C   9.2200004E-02  0.4202000     -0.3685000    
 C   -3.520100      0.5518000      0.2872000    
 C    4.381300      -1.783500     -0.8241000    
 C    3.639400      -2.476200      0.3348000    
 C    4.231600     -0.2619000     -0.8122000    
 C    2.351800       1.358400     -0.5534000    
 C    3.861600      -3.999000      0.2678000    
 C   -2.633300      -1.600800     -0.3428000    
 C   -1.353100       4.340000      0.7481000    
 C    1.453100       3.835200      0.1505000    
 C   -4.816500      3.5999998E-02  0.3978000    
 C   -3.923900      -2.131500     -0.2363000    
 C    2.783600       3.573400     -0.1384000    
 C   -4.997900      -1.323200      0.1287000    
 C    3.136100      -4.773400       1.360700    
 C   -2.990300      -4.227800     -0.8606000    
 H   0.4145000     -0.5815000     -0.6355000    
 H    4.005100      -2.178500      -1.776900    
 H    5.450700      -2.028400     -0.7832000    
 H    2.562500      -2.288800      0.2426000    
 H   -3.642600       2.606100      0.7626000    
 H    4.689200      0.1621000      8.8600002E-02
 H    4.781000      0.1533000      -1.665600    
 H    2.277300     -0.4569000      -1.559700    
 H    4.933100      -4.228800      0.3239000    
 H    3.511900      -4.366400     -0.7051000    
 H   -1.762300      -2.181400     -0.6219000    
 H  -0.8710000       4.686300       1.668800    
 H   -1.170000       5.065300     -5.2000001E-02
 H   -2.430100       4.344000      0.9361000    
 H    1.174400       4.847600      0.4229000    
 H   -5.653300      0.6650000      0.6821000    
 H    3.526300       4.363200     -9.2699997E-02
 H   -5.995400      -1.749100      0.2078000    
 H    3.606700      -2.390400       2.382400    
 H    3.821200     -0.9456000       1.685200    
 H    2.070100      -4.525500       1.377200    
 H    3.229600      -5.849200       1.179800    
 H    3.557500      -4.571400       2.349800    
 H   -3.336500      -5.253200      -1.026800    
 H   -2.251600      -4.268300     -5.2900001E-02
 H   -2.556000      -3.881700      -1.804800    


%chk=000153588-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153588

0 1
O -5.588301 -2.615313 -1.741749
N -3.267242 1.821218 0.773261
N 2.268051 -0.855453 -1.228779
N 3.132131 1.075512 -0.222642
N 5.404782 -0.865021 0.590085
C -1.745014 0.396606 -0.211991
C -1.895338 1.626431 0.541980
C -0.806229 2.425866 0.919507
C 0.675245 0.730783 -0.205355
C -3.084952 -0.139866 -0.430869
C 0.503028 1.973448 0.534105
C -0.465205 -0.036305 -0.577916
C -4.001209 0.766671 0.193581
C 4.211176 -2.453508 -0.875066
C 4.545197 -2.071537 0.588612
C 3.583649 -1.312545 -1.712257
C 2.045724 0.326805 -0.543691
C 5.262477 -3.249709 1.291464
C -3.568189 -1.293839 -1.095493
C -0.990155 3.718069 1.693321
C 1.684167 2.734075 0.849911
C -5.393772 0.541869 0.168951
C -4.963955 -1.515390 -1.119841
C 2.929864 2.261398 0.451531
C -5.865680 -0.606489 -0.493069
C 5.483059 -3.043008 2.806738
C -4.722656 -3.585458 -2.410062
H -0.368485 -0.959434 -1.160949
H 3.537501 -3.336624 -0.878654
H 5.154725 -2.749405 -1.376169
H 3.576979 -1.901537 1.126843
H -3.673838 2.605588 1.275394
H 4.254923 -0.439530 -1.718015
H 3.465927 -1.652634 -2.760543
H 1.476715 -1.477874 -1.379056
H 6.236661 -3.411115 0.787636
H 4.659979 -4.167593 1.137456
H -2.871378 -1.987633 -1.574773
H -0.445939 3.693975 2.656179
H -0.607465 4.587041 1.125294
H -2.049795 3.922328 1.924667
H 1.612693 3.678013 1.394893
H -6.097968 1.231845 0.645537
H 3.841344 2.828209 0.672803
H -6.935471 -0.829938 -0.543755
H 5.879585 -0.717187 1.487708
H 4.875957 -0.022872 0.301609
H 4.526807 -2.825524 3.319614
H 5.919434 -3.946766 3.270723
H 6.175778 -2.205881 3.014988
H -5.402941 -4.346398 -2.820201
H -4.020554 -4.060619 -1.696191
H -4.149724 -3.115846 -3.234402


