%chk=000004893.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004893

0 1
 O   -5.714500      -1.144600      -1.628000    
 O   -5.496000      0.7234000       1.304700    
 O    5.492600       2.484500     -0.3391000    
 O    6.713700      7.4699998E-02  0.3114000    
 N  -0.8973000     -0.6704000     -0.2587000    
 N   -3.774300     -0.4868000     -0.5557000    
 N    1.223800      0.3745000     -0.2843000    
 N    1.014100      -1.973700      0.2143000    
 N    2.916500      -3.275600      0.6856000    
 C   -1.536700      0.6027000     -0.6016000    
 C   -1.751300      -1.849600     -9.2399999E-02
 C   -2.972200      0.6448000     -7.6899998E-02
 C   -3.037500      -1.700200     -0.9019000    
 C   0.4838000     -0.7610000     -0.1052000    
 C   -5.165900     -0.4483000     -0.7712000    
 C    2.558100      0.2945000     -0.1380000    
 C   -5.952100      0.4630000      5.7300001E-02
 C    3.188200     -0.9170000      0.1904000    
 C    2.352600      -2.018600      0.3533000    
 C    3.361400       1.419300     -0.3092000    
 C    4.584000     -0.9888000      0.3409000    
 C   -7.115700       1.135600     -0.1979000    
 C    4.750200       1.356200     -0.1612000    
 C    5.362500      0.1509000      0.1640000    
 C   -7.402900       1.867700      0.9787000    
 C   -6.388200       1.583400       1.862700    
 C    5.964600       2.748300      -1.658800    
 C    7.238600      0.3112000       1.616800    
 H   -1.526500      0.7255000      -1.691300    
 H   -1.000000       1.452400     -0.1637000    
 H   -1.983800      -1.975300      0.9718000    
 H   -1.247500      -2.760400     -0.4365000    
 H   -2.962100      0.5900000       1.018200    
 H   -3.457700       1.582800     -0.3662000    
 H   -2.809700      -1.638700      -1.973400    
 H   -3.687000      -2.570700     -0.7558000    
 H    2.898900       2.372000     -0.5633000    
 H    5.089900      -1.918900      0.5854000    
 H   -7.692000       1.109800      -1.111700    
 H    3.710700      -3.297500       1.312800    
 H    2.260300      -4.044200      0.7633000    
 H   -8.244000       2.521200       1.159700    
 H   -6.167200       1.895400       2.873000    
 H    6.614700       1.938500      -2.004700    
 H    6.543200       3.675800      -1.636700    
 H    5.124000       2.876200      -2.348200    
 H    6.855700     -0.4314000       2.324000    
 H    6.985400       1.320300       1.956800    
 H    8.327200      0.2208000       1.569600    


%chk=000004893-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000004893

0 1
O -5.788296 -1.693943 -0.358501
O -5.076762 1.682091 0.935800
O 5.381193 2.560527 -0.192914
O 6.579407 0.084167 0.781148
N -0.949645 -0.780180 -0.906692
N -3.792282 -0.516884 -0.640077
N 1.117537 0.330804 -0.685427
N 0.872941 -2.061803 -0.189924
N 2.634524 -3.390996 0.523008
C -1.611238 0.477481 -1.292098
C -1.792026 -1.994184 -0.800285
C -2.911710 0.677624 -0.493556
C -3.203706 -1.691137 -1.328691
C 0.395118 -0.818328 -0.585340
C -5.095063 -0.633376 -0.169484
C 2.453939 0.243067 -0.337863
C -5.740652 0.475179 0.576697
C 3.064309 -0.992593 0.103319
C 2.180093 -2.147372 0.141460
C 3.274893 1.409954 -0.436042
C 4.437595 -1.006982 0.479681
C -7.044561 0.520086 1.059149
C 4.628110 1.369662 -0.096363
C 5.215493 0.150778 0.403033
C -7.216505 1.780273 1.737733
C -6.009168 2.455218 1.644292
C 6.527292 2.500773 -1.132404
C 6.918642 0.896388 1.974686
H -1.823761 0.488663 -2.380790
H -0.906163 1.297768 -1.083838
H -1.839489 -2.333011 0.252582
H -1.342593 -2.819837 -1.382326
H -2.670998 0.843130 0.572538
H -3.429628 1.581662 -0.859395
H -3.176396 -1.512760 -2.421905
H -3.875237 -2.546303 -1.150040
H 2.832993 2.341645 -0.797960
H 4.931876 -1.908475 0.859758
H -7.771900 -0.277296 0.928860
H 3.605973 -3.566001 0.758272
H 1.964529 -4.157387 0.531237
H -8.116441 2.140482 2.231859
H -5.650237 3.419667 1.993730
H 7.215311 1.678977 -0.865583
H 7.030152 3.475269 -1.039828
H 6.158097 2.364056 -2.166293
H 6.375862 0.515156 2.860653
H 6.668052 1.959976 1.810769
H 8.003125 0.772026 2.116458


