%chk=000093737.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093737

0 1
 O  -0.7298000       1.425200       1.057300    
 O   -4.672500       1.057000      0.6769000    
 N   0.8555000     -4.4599999E-02  0.1998000    
 N   -2.709700     -0.2190000      0.6364000    
 C   -1.565700     -0.3735000     -0.2171000    
 C   -2.024900      0.1997000      -1.544300    
 C  -0.4571000      0.4158000      0.4022000    
 C   -3.095900       1.221600      -1.164000    
 C    1.144100      -1.252100     -0.5867000    
 C    1.994200      0.6374000      0.7497000    
 C   -3.632800      0.6982000      0.1457000    
 C    1.163600      -2.513600      0.2699000    
 C    2.550100       1.697300     -0.1956000    
 C    1.490800      -3.769800     -0.5407000    
 C    3.780000       2.407200      0.3749000    
 C    1.562500      -5.001400      0.3486000    
 C    4.347500       3.414600     -0.6129000    
 H   -1.364100      -1.442200     -0.2730000    
 H   -1.220800      0.6475000      -2.136500    
 H   -2.485000     -0.5924000      -2.148500    
 H   -2.664000       2.213400     -0.9986000    
 H   -3.886500       1.278600      -1.916200    
 H    2.118500      -1.117600      -1.072700    
 H   0.4226000      -1.353500      -1.402800    
 H    1.691500       1.124000       1.684800    
 H    2.766600     -9.5100001E-02   1.011300    
 H   -2.819900     -0.6965000       1.525700    
 H    1.909800      -2.397000       1.066200    
 H   0.2015000      -2.646300      0.7779000    
 H    1.770500       2.437100     -0.4176000    
 H    2.813500       1.231500      -1.153600    
 H    2.450600      -3.641200      -1.054200    
 H   0.7267000      -3.922300      -1.311500    
 H    4.553500       1.670400      0.6202000    
 H    3.513100       2.921200       1.305500    
 H    1.795000      -5.887700     -0.2500000    
 H   0.6081000      -5.174700      0.8559000    
 H    2.341700      -4.891400       1.109500    
 H    4.655500       2.923400      -1.541400    
 H    5.223500       3.912300     -0.1853000    
 H    3.606900       4.182200     -0.8592000    


%chk=000093737-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093737

0 1
O -0.599555 1.437840 1.269227
O -4.740736 1.461180 0.510228
N 0.817326 -0.109637 0.261645
N -2.901281 -0.008461 0.675997
C -1.669206 -0.357504 -0.032569
C -1.988458 0.112206 -1.500661
C -0.441264 0.393339 0.561261
C -3.037552 1.235636 -1.322123
C 1.075172 -1.322045 -0.549421
C 2.000581 0.617731 0.786559
C -3.694015 0.945688 0.039699
C 1.207236 -2.616574 0.289113
C 2.513042 1.701180 -0.189021
C 1.562718 -3.843723 -0.580975
C 3.767445 2.426949 0.348507
C 1.682869 -5.143186 0.243759
C 4.283363 3.514558 -0.617785
H -1.498716 -1.448434 0.005206
H -1.081694 0.449384 -2.029830
H -2.424032 -0.732423 -2.063357
H -2.571731 2.235735 -1.260504
H -3.799577 1.263827 -2.116851
H 2.015778 -1.155233 -1.110346
H 0.285259 -1.447286 -1.311225
H 1.709931 1.091186 1.740493
H 2.798362 -0.122380 0.992547
H -3.025236 -0.192299 1.672623
H 1.984778 -2.472009 1.065580
H 0.257933 -2.805005 0.830235
H 1.701077 2.434540 -0.356234
H 2.745671 1.242014 -1.172595
H 2.517728 -3.652645 -1.112115
H 0.790690 -3.974599 -1.367043
H 4.572069 1.685935 0.536299
H 3.529376 2.885875 1.329233
H 1.937635 -6.005465 -0.398724
H 0.732646 -5.375678 0.759913
H 2.470014 -5.052429 1.015415
H 4.556228 3.079462 -1.597846
H 5.177613 4.022359 -0.212632
H 3.509211 4.284089 -0.795682


