%chk=000149469.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149469

0 1
 O   5.6299999E-02  0.1222000       2.002500    
 O   0.3447000       3.413500      0.7809000    
 O  -0.2996000      -2.918000     -0.5391000    
 O    2.469700       3.731900       1.483000    
 N   0.7415000      0.9680000     -4.6700001E-02
 N   -1.696000      -1.521300      0.6842000    
 N    3.089800     -0.7816000      -1.171100    
 N   -7.153700       1.808100      -1.212400    
 N    5.243800      -1.303300      -1.028900    
 N  -0.7377000      -4.932400       1.282700    
 C   -1.328200     -0.2792000      5.2499998E-02
 C   -2.463700      0.7501000      8.0200002E-02
 C   -3.727800      0.2508000     -0.6276000    
 C   -4.853800       1.284800     -0.5464000    
 C  -0.1106000      0.2642000      0.7927000    
 C    1.938900       1.619700      0.4299000    
 C    3.012000       1.692900     -0.6649000    
 C   -6.101500      0.8014000      -1.283900    
 C    3.735900      0.3799000     -0.8540000    
 C   -1.147500      -2.749400      0.3345000    
 C    1.629000       3.016400      0.9485000    
 C   -1.740900      -3.887000       1.139900    
 C    5.063800      3.2699998E-02 -0.7711000    
 C    4.035700      -1.764300      -1.265400    
 H   -1.051200     -0.4952000     -0.9868000    
 H   -2.125100       1.682400     -0.3893000    
 H   -2.708600      0.9996000       1.121300    
 H   -3.495700      3.7300002E-02  -1.678100    
 H   -4.072800     -0.6861000     -0.1750000    
 H   -5.094500       1.480900      0.5061000    
 H   -4.510900       2.232200     -0.9812000    
 H    2.307300       1.054100       1.295800    
 H   0.4750000       1.107200      -1.017200    
 H   -2.350000      -1.479500       1.460600    
 H    3.762500       2.452800     -0.4119000    
 H    2.572600       1.999800      -1.622800    
 H   -6.463100     -0.1344000     -0.8438000    
 H   -5.865900      0.6064000      -2.335700    
 H    2.094600     -0.8964000      -1.310700    
 H   -2.623700      -4.265600      0.6153000    
 H   -2.043200      -3.539200       2.132500    
 H   -7.995000       1.450300      -1.662900    
 H   -7.401300       1.977500     -0.2383000    
 H    5.900900      0.6753000     -0.5393000    
 H    3.779800      -2.785900      -1.507400    
 H   0.1911000       4.316600       1.131800    
 H   -1.132500      -5.707200       1.814500    
 H  -0.5053000      -5.311500      0.3652000    


%chk=000149469-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149469

0 1
O -0.403349 2.019485 1.337993
O 1.335031 3.425511 -1.506291
O 0.118893 -1.381406 -1.673335
O 3.286111 3.805885 -0.309264
N 0.855276 1.036849 -0.364650
N -1.418556 -0.956337 0.015121
N 2.741983 -1.691690 0.135059
N -7.905707 1.113248 0.040992
N 4.034887 -2.159169 1.933356
N 0.502723 -3.954329 -0.900162
C -1.538202 0.497693 -0.271206
C -2.865658 1.052635 0.274310
C -4.119892 0.441808 -0.388744
C -5.425589 1.075457 0.140760
C -0.315805 1.266254 0.323932
C 2.116285 1.660736 0.014876
C 3.342515 0.764804 -0.369790
C -6.692922 0.457240 -0.484383
C 3.452334 -0.511441 0.415725
C -0.630106 -1.799424 -0.718602
C 2.320998 3.061933 -0.586484
C -0.693087 -3.292628 -0.369694
C 4.244399 -0.831018 1.527887
C 3.120171 -2.646719 1.067929
H -1.501017 0.602031 -1.373117
H -2.856336 2.146618 0.118377
H -2.893965 0.916781 1.373788
H -4.063055 0.585095 -1.487887
H -4.151423 -0.655418 -0.221815
H -5.468999 0.959063 1.244969
H -5.434629 2.163536 -0.060868
H 2.117602 1.809657 1.110945
H 0.817622 0.389491 -1.166983
H -1.921343 -1.316455 0.830262
H 4.248532 1.367010 -0.186368
H 3.305064 0.563638 -1.459664
H -6.667118 -0.650521 -0.321737
H -6.666983 0.616502 -1.580141
H 2.045306 -1.844383 -0.601216
H -1.662404 -3.680456 -0.773019
H -0.731140 -3.415041 0.729848
H -8.768804 0.889355 -0.462436
H -8.019201 1.029686 1.056216
H 4.950552 -0.188357 2.050775
H 2.711749 -3.653276 1.062203
H 1.531537 4.344002 -1.838463
H 0.559888 -4.957759 -0.711692
H 0.700930 -3.704674 -1.874609


