%chk=000165417.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165417

0 1
 O  -0.9661000      0.8335000     -0.2220000    
 O   0.1625000      -1.973500     -0.9277000    
 O   0.2906000       2.349100       1.603200    
 O    3.306200      -2.089500      0.7848000    
 O   8.8999998E-03   2.285000      -1.718100    
 O    1.138300       4.249900     -3.3300001E-02
 O   0.8413000      -2.952800       1.045300    
 N   -3.872000     -0.2125000      0.2556000    
 C   -2.844700     -0.6467000     -0.7354000    
 C   -2.073600      0.6182000      -1.118400    
 C   -3.115000       1.706200     -0.8842000    
 C   -3.780000       1.243400      0.4056000    
 C   -2.103100      -1.775100     -9.7000003E-02
 C   -3.607000     -0.9649000       1.497000    
 C    1.781200      0.5793000      0.8154000    
 C    2.446800     -0.1420000     -0.4163000    
 C    1.042200       1.914300      0.4599000    
 C   -2.549000      -1.960800       1.149400    
 C    2.447400      -1.703600     -0.2881000    
 C   -1.120100      -2.618200     -0.8323000    
 C  -9.7000003E-03   1.717600     -0.6323000    
 C    2.729300      0.7607000       2.014800    
 C    3.871500      0.3693000     -0.7044000    
 C    1.943600       3.093300      9.0599999E-02
 C    1.071300      -2.280900      4.5899998E-02
 C    2.959300      -2.399400      -1.558200    
 H   -3.393800      -1.014000      -1.612100    
 H   -1.728000      0.5748000      -2.157400    
 H   -3.842300       1.724300      -1.704700    
 H   -2.683100       2.704700     -0.7690000    
 H   -3.155700       1.541300       1.257100    
 H   -4.769600       1.691600      0.5342000    
 H   0.9942000     -8.4100001E-02   1.196000    
 H   -4.521600      -1.477500       1.811700    
 H   -3.261000     -0.3371000       2.325400    
 H    1.843700      9.3099996E-02  -1.301900    
 H   -2.206700      -2.734400       1.821400    
 H   -1.021800      -3.612000     -0.3780000    
 H   -1.472800      -2.789100      -1.855400    
 H    3.575800       1.412300       1.781000    
 H    2.201400       1.200300       2.867700    
 H    3.129300     -0.1975000       2.355800    
 H    4.211000      3.5700001E-02  -1.690300    
 H    3.932400       1.457400     -0.7114000    
 H    4.593600      6.0000001E-03  3.3900000E-02
 H    2.468400       2.949000     -0.8565000    
 H    2.674100       3.304700      0.8758000    
 H    2.438800      -2.042500      -2.453100    
 H    4.036400      -2.253500      -1.691500    
 H    2.806500      -3.484000      -1.496900    
 H  -0.2758000       1.612400       1.890500    
 H    3.382600      -3.059000      0.7819000    
 H   0.6241000       4.174900     -0.8545000    


%chk=000165417-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165417

0 1
O -1.048344 0.864707 -0.166292
O 0.184423 -1.996893 -1.047068
O 0.261731 2.102183 1.822700
O 3.368627 -2.110186 0.780288
O 0.191890 2.041314 -1.748196
O 1.086977 4.228866 -0.200458
O 0.831519 -2.953694 0.977017
N -3.879429 -0.197918 0.315800
C -2.918144 -0.630545 -0.754852
C -2.155384 0.656860 -1.157451
C -3.217998 1.751387 -0.927363
C -3.927443 1.289872 0.374560
C -2.145428 -1.779641 -0.124884
C -3.592004 -0.944610 1.571990
C 1.899051 0.525151 0.829951
C 2.493369 -0.140388 -0.467497
C 1.027439 1.829251 0.590741
C -2.531431 -1.950605 1.167611
C 2.505906 -1.710053 -0.341182
C -1.185868 -2.641888 -0.886360
C 0.046742 1.613789 -0.576026
C 2.940878 0.797493 1.941152
C 3.908544 0.357396 -0.846944
C 1.861872 3.113501 0.335190
C 1.092539 -2.265562 -0.045571
C 3.031948 -2.407329 -1.621457
H -3.454138 -0.974135 -1.668399
H -1.717558 0.645337 -2.168659
H -3.922656 1.745153 -1.779386
H -2.778676 2.758518 -0.848672
H -3.379073 1.673621 1.265270
H -4.964846 1.666507 0.428921
H 1.160855 -0.192829 1.249479
H -4.495704 -1.445601 1.976408
H -3.217065 -0.267190 2.377633
H 1.815257 0.073769 -1.317616
H -2.137828 -2.713530 1.845556
H -1.032833 -3.612654 -0.386913
H -1.494339 -2.786060 -1.935138
H 3.718608 1.509907 1.616404
H 2.440204 1.217496 2.830432
H 3.443583 -0.144007 2.214059
H 4.187042 0.025087 -1.861949
H 3.964760 1.458885 -0.846308
H 4.661988 -0.025539 -0.138169
H 2.717858 2.881068 -0.325990
H 2.234474 3.459244 1.310780
H 2.521254 -2.032720 -2.524865
H 4.114893 -2.226669 -1.706670
H 2.881730 -3.499401 -1.554502
H -0.466511 1.429303 1.882232
H 2.816671 -2.662859 1.401490
H 0.830269 3.994544 -1.131329


