%chk=000149362.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149362

0 1
 O    2.648800      0.8372000      -1.041500    
 O   0.8678000       2.444500      0.9700000    
 O    3.376900       2.682800       1.952400    
 O    5.161200      0.4553000      -1.339000    
 N    1.420700     -0.9665000     -9.0300001E-02
 N    5.777100       2.237000      2.6799999E-02
 N    2.095200      -3.082600      0.1251000    
 N  -0.9864000      -1.293900     -5.6800000E-02
 N   -1.558700      -3.654000      0.1844000    
 N   -3.214300      -2.005300      1.8100001E-02
 N   0.1025000      -5.367500      0.3603000    
 C    1.623500       1.238800       1.083100    
 C    1.500600      0.4878000     -0.2398000    
 C    3.105700       1.545900       1.157900    
 C    3.459300       1.757700     -0.3004000    
 C    4.875400       1.402200     -0.6109000    
 C   0.2840000      -1.722300     -1.3100000E-02
 C    2.481700      -1.830500     -3.1000001E-03
 C   0.7239000      -3.029600      0.1205000    
 C  -0.2533000      -4.014800      0.2215000    
 C    7.209800       2.090200     -9.1100000E-02
 C   -1.840000      -2.335400      4.9500000E-02
 C    7.576500      0.9253000     -0.9871000    
 C   -3.684400     -0.6633000     -0.1169000    
 C   -5.209800     -0.6088000     -4.6599999E-02
 C   -5.757200      0.7948000     -0.1384000    
 C   -5.944100       1.528600       1.022600    
 C   -6.062600       1.325200      -1.382000    
 C   -6.449700       2.825800      0.9379000    
 C   -6.568300       2.622600      -1.466600    
 C   -6.761700       3.372800     -0.3066000    
 H    1.255600      0.6961000       1.959200    
 H   0.6137000      0.7895000     -0.8094000    
 H    3.650900      0.6883000       1.571000    
 H    3.252800       2.777200     -0.6464000    
 H  -6.9600001E-02   2.194200      0.9010000    
 H    3.026100       2.507100       2.842100    
 H    3.510100      -1.498500     -3.2099999E-02
 H    5.429300       2.994600      0.6074000    
 H    7.606600       3.029200     -0.4891000    
 H    7.611400       1.949200      0.9171000    
 H   -3.867000      -2.777200      9.1100000E-02
 H    8.671300      0.8663000      -1.036000    
 H    7.249300       1.063400      -2.022800    
 H    7.254200     -4.0800001E-02 -0.5849000    
 H   -3.265800     -3.6600001E-02  0.6812000    
 H   -3.347600     -0.2405000      -1.071800    
 H    1.075900      -5.639500      0.3876000    
 H  -0.6260000      -6.064800      0.4311000    
 H   -5.642700      -1.223000     -0.8479000    
 H   -5.557900      -1.073000      0.8864000    
 H   -5.701900       1.112000       1.996100    
 H   -5.913300      0.7494000      -2.290800    
 H   -6.599800       3.410200       1.840900    
 H   -6.810700       3.048900      -2.435700    
 H   -7.155000       4.383000     -0.3726000    


%chk=000149362-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149362

0 1
O 2.764004 0.556353 -1.780491
O 0.702119 2.472977 -0.463024
O 2.779533 2.761287 1.136647
O 5.286480 -0.357979 -0.932533
N 1.461879 -1.191429 -0.775130
N 5.684514 1.632565 0.235373
N 2.117407 -3.354714 -0.402285
N -0.934334 -1.359503 -0.160105
N -1.530454 -3.661115 0.537628
N -3.118963 -1.955910 0.490894
N 0.039203 -5.423683 0.602667
C 1.218986 1.171373 -0.022708
C 1.463067 0.217430 -1.220448
C 2.654084 1.468555 0.485895
C 3.515953 1.379436 -0.817947
C 4.912488 0.785097 -0.537072
C 0.319721 -1.869017 -0.338953
C 2.519576 -2.135642 -0.804109
C 0.746215 -3.200507 -0.112791
C -0.254735 -4.109126 0.347796
C 7.047765 1.291696 0.682191
C -1.809266 -2.330537 0.278244
C 8.106269 2.274945 0.142740
C -3.611695 -0.591534 0.288546
C -5.145778 -0.534656 0.494320
C -5.675574 0.878811 0.303604
C -5.701692 1.794586 1.386997
C -6.110765 1.325094 -0.970723
C -6.150249 3.122134 1.203513
C -6.560361 2.651749 -1.159587
C -6.580693 3.555691 -0.072127
H 0.559440 0.713784 0.733715
H 0.698559 0.342664 -2.007751
H 2.967972 0.712042 1.222710
H 3.617211 2.396167 -1.244662
H -0.276074 2.426045 -0.592220
H 2.095137 3.348709 0.707363
H 3.523786 -1.845689 -1.113283
H 5.254733 2.500622 0.573863
H 7.075166 1.269073 1.789257
H 7.245024 0.268573 0.319798
H -3.740502 -2.688597 0.833011
H 9.111422 1.983637 0.498389
H 7.912737 3.308577 0.485296
H 8.113990 2.271272 -0.960974
H -3.112887 0.108120 0.990597
H -3.351846 -0.248140 -0.731407
H 0.988761 -5.759089 0.455360
H -0.696015 -6.048421 0.924440
H -5.627434 -1.226690 -0.223203
H -5.383562 -0.897369 1.513993
H -5.376321 1.462297 2.381041
H -6.102644 0.627076 -1.817405
H -6.169825 3.814466 2.052917
H -6.898518 2.977844 -2.149747
H -6.933013 4.583299 -0.215523


