%chk=000149237.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149237

0 1
 O    4.346000       4.135500     -8.8900000E-02
 O    5.560800       2.558600      0.8367000    
 O   -5.678700       1.542300       2.052000    
 O   -6.662200       1.727400      1.1200000E-02
 N  -0.7392000     -0.4541000      -1.313700    
 N    2.836700      -1.557500      0.5738000    
 N    4.511000       2.943700      0.2673000    
 C   0.4736000     -0.8282000     -0.6742000    
 C    1.465300      0.1326000     -0.4516000    
 C   0.6647000      -2.153900     -0.2721000    
 C    2.647500     -0.2820000      0.1846000    
 C    1.878300      -2.479000      0.3570000    
 C    1.300100       1.471900     -0.8452000    
 C  -0.3147000      -3.140100     -0.4833000    
 C    3.638600      0.6700000      0.4089000    
 C   -1.962200      1.4400000E-02 -0.8160000    
 C    2.074500      -3.797400      0.7595000    
 C    3.477700       2.001800      1.8999999E-02
 C    2.306200       2.404100     -0.6094000    
 C  -9.3800001E-02  -4.451000     -7.1400002E-02
 C    1.103400      -4.779800      0.5513000    
 C   -3.013100      0.3141000      -1.690500    
 C   -2.145500      0.1871000      0.5608000    
 C   -4.230700      0.7805000      -1.195000    
 C   -3.363200      0.6534000       1.056200    
 C   -4.405700      0.9501000      0.1782000    
 C   -5.675500       1.435600      0.6948000    
 H  -0.6959000     -0.5513000      -2.323900    
 H   0.3984000       1.818700      -1.343200    
 H   -1.260100      -2.918300     -0.9715000    
 H    4.552500      0.3420000      0.9029000    
 H    3.004500      -4.080200       1.249500    
 H    2.141600       3.429600     -0.9289000    
 H  -0.8513000      -5.211000     -0.2366000    
 H    1.286000      -5.799900      0.8764000    
 H   -2.891400      0.1868000      -2.763500    
 H   -1.350600     -3.6200002E-02   1.267800    
 H   -5.030500       1.005900      -1.895600    
 H   -3.456600      0.7709000       2.132200    
 H   -6.539300       1.869800       2.390300    


%chk=000149237-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149237

0 1
O 4.393378 4.197580 -0.080670
O 5.634874 2.579832 0.942664
O -5.674496 1.531353 2.159486
O -6.705764 1.705869 0.084621
N -0.759946 -0.452157 -1.494468
N 2.837125 -1.560275 0.629511
N 4.578321 2.983861 0.322804
C 0.422946 -0.814040 -0.762642
C 1.429147 0.158531 -0.502310
C 0.609821 -2.153655 -0.314864
C 2.634235 -0.274380 0.202667
C 1.853865 -2.480733 0.384533
C 1.310442 1.536302 -0.902501
C -0.364843 -3.190459 -0.520644
C 3.670925 0.683139 0.466452
C -1.952016 0.004203 -0.912038
C 2.065711 -3.830699 0.837090
C 3.500465 1.997395 0.049521
C 2.321975 2.447619 -0.635947
C -0.124503 -4.483030 -0.064332
C 1.100844 -4.807688 0.617702
C -3.065089 0.314608 -1.751008
C -2.078426 0.166017 0.498990
C -4.265536 0.771088 -1.191424
C -3.286199 0.624885 1.048419
C -4.394385 0.932853 0.215440
C -5.680893 1.416868 0.754677
H -0.738596 -0.558266 -2.510342
H 0.398707 1.855040 -1.415879
H -1.299690 -2.939926 -1.031253
H 4.574033 0.361529 0.990158
H 3.005887 -4.043753 1.354088
H 2.251190 3.498128 -0.927328
H -0.874278 -5.266115 -0.219886
H 1.266233 -5.832824 0.965497
H -2.976867 0.194614 -2.837915
H -1.233650 -0.068977 1.153774
H -5.124846 1.011652 -1.826065
H -3.385989 0.750477 2.130221
H -6.566911 1.860434 2.449101


