%chk=000003622.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003622

1 1
 O   4.2199999E-02  0.9786000      0.9038000    
 O   0.7139000       1.930700      -1.086600    
 O    3.106800       2.544500      0.1798000    
 N   -3.335000      -1.190200     -7.0500001E-02
 C   -3.576400     -0.1038000      0.9983000    
 C   -2.790900     -0.3165000      -1.220000    
 C   -4.279800       1.007300      0.2014000    
 C   -3.769600      0.8693000      -1.238900    
 C   -2.225200      0.3971000       1.539100    
 C   -1.370800      0.1656000     -0.8737000    
 C   -1.304800      0.9540000      0.4434000    
 C   -2.409800      -2.324500      0.3661000    
 C   -4.652900      -1.883100     -0.4706000    
 C   0.9613000       1.497500      3.1800002E-02
 C    2.349900       1.433100      0.6369000    
 C    3.084700      0.1658000      0.2746000    
 C    2.963700     -0.9475000       1.091500    
 C    3.867800      0.1372000     -0.8687000    
 C    3.643000      -2.118800      0.7567000    
 C    4.547200      -1.034100      -1.203500    
 C    4.434800      -2.162200     -0.3909000    
 H   -4.199100     -0.5236000       1.795200    
 H   -2.804600     -0.9019000      -2.145400    
 H   -4.083800       2.004500      0.6099000    
 H   -5.367300      0.8707000      0.2268000    
 H   -4.608700      0.6658000      -1.914300    
 H   -3.302600       1.793600      -1.596000    
 H   -2.400800       1.189100       2.279400    
 H   -1.715500     -0.3902000       2.106600    
 H  -0.6655000     -0.6738000     -0.8689000    
 H   -1.062400      0.7892000      -1.718900    
 H   -1.607700       1.992800      0.2536000    
 H   -2.879700      -2.839000       1.209800    
 H   -2.285500      -3.005400     -0.4814000    
 H   -1.434800      -1.945200      0.6707000    
 H   -5.032300      -2.418400      0.4051000    
 H   -5.389500      -1.149900     -0.8014000    
 H   -4.434400      -2.580100      -1.285200    
 H    2.281000       1.535900       1.726500    
 H    2.687800       3.349000      0.5308000    
 H    2.347900     -0.9240000       1.986000    
 H    3.960600      0.9965000      -1.526300    
 H    3.554700      -2.997500       1.389000    
 H    5.160900      -1.069200      -2.099000    
 H    4.962800      -3.074600     -0.6523000    


%chk=000003622-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000003622

1 1
O 0.009072 0.835162 0.980242
O 0.755771 2.093652 -0.837764
O 3.010958 2.686095 0.778303
N -3.539464 -1.206628 0.072203
C -3.709925 0.094453 0.935544
C -2.811166 -0.597925 -1.178768
C -4.270724 1.104135 -0.105122
C -3.682127 0.652738 -1.487984
C -2.335389 0.526921 1.489840
C -1.368045 -0.217499 -0.796520
C -1.335025 0.826233 0.352362
C -2.780173 -2.329796 0.762401
C -4.902386 -1.774382 -0.320014
C 1.005589 1.524283 0.238887
C 2.359174 1.388071 0.941641
C 3.145510 0.233831 0.316021
C 3.461267 -0.914569 1.081693
C 3.587412 0.329372 -1.029880
C 4.216039 -1.963519 0.508452
C 4.341903 -0.719241 -1.598611
C 4.656519 -1.867346 -0.831993
H -4.413833 -0.136136 1.753221
H -2.827591 -1.358223 -1.978032
H -3.955899 2.125694 0.160738
H -5.372665 1.107204 -0.114846
H -4.479750 0.424602 -2.213290
H -3.055927 1.436195 -1.943257
H -2.490564 1.437413 2.095232
H -1.916650 -0.224934 2.180661
H -0.769231 -1.103803 -0.521510
H -0.884412 0.214682 -1.689872
H -1.511620 1.832044 -0.071939
H -3.357842 -2.654180 1.642205
H -2.678404 -3.169042 0.056593
H -1.785842 -2.001617 1.081210
H -5.419344 -2.114237 0.590901
H -5.509238 -1.012271 -0.822845
H -4.747723 -2.627778 -0.998387
H 2.170001 1.165990 2.010808
H 3.987308 2.569528 0.900770
H 3.134555 -0.981946 2.126781
H 3.341542 1.222555 -1.615511
H 4.471236 -2.844327 1.107311
H 4.689984 -0.640986 -2.634183
H 5.248717 -2.676166 -1.273392


