%chk=000043102.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043102

0 1
 O  -0.4449000       1.325800     -0.9772000    
 N   -2.704300      0.2327000     -0.2519000    
 N   0.7916000     -0.5096000     -0.2360000    
 C   -2.480200      0.9184000       1.026900    
 C   -3.996000     -0.4650000     -0.2225000    
 C   -1.625400     -0.6837000     -0.5463000    
 C   0.8797000      -1.918200      0.2029000    
 C    2.348500      -2.217400      0.5218000    
 C    2.088200      4.5200001E-02 -0.2100000    
 C    3.009000     -0.9121000      0.2209000    
 C  -0.3692000      0.1527000     -0.6112000    
 C   -1.178100       1.712900      0.9802000    
 C   -2.456200     -0.1073000       2.155800    
 C   -4.276900      -1.115500      -1.574200    
 C   -5.097800      0.5218000      0.1503000    
 C    2.504100       1.327300     -0.5387000    
 C    4.358900     -0.6149000      0.3332000    
 C    3.863900       1.635300     -0.4285000    
 C    4.785200      0.6715000      4.4000000E-03
 H   -3.254000       1.666000       1.229600    
 H   -4.014500      -1.291200      0.4978000    
 H   -1.577000      -1.531600      0.1361000    
 H   -1.712600      -1.097900      -1.557700    
 H   0.4955000      -2.567000     -0.5922000    
 H   0.2612000      -2.058000       1.095900    
 H    2.735500      -3.016000     -0.1186000    
 H    2.476200      -2.494600       1.572800    
 H   -1.255800       2.300400       1.919800    
 H  -0.2347000       1.236700       1.264600    
 H   -1.191200       2.592500      0.3203000    
 H   -3.402800     -0.6297000       2.313300    
 H   -2.272000      0.4215000       3.100800    
 H   -1.651000     -0.8426000       2.083500    
 H   -5.308500      -1.484400      -1.616300    
 H   -4.153300     -0.4040000      -2.398700    
 H   -3.636900      -1.983300      -1.762700    
 H   -5.116400      0.7652000       1.217200    
 H   -6.082100      8.8200003E-02 -6.5200001E-02
 H   -5.031200       1.450400     -0.4286000    
 H    1.820500       2.096500     -0.8760000    
 H    5.070700      -1.361600      0.6687000    
 H    4.211400       2.633700     -0.6810000    
 H    5.837500      0.9299000      8.3899997E-02


%chk=000043102-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043102

0 1
O -0.335391 1.266395 -0.754748
N -2.698290 0.155794 0.436711
N 0.991710 -0.512242 -0.038098
C -3.197401 0.781008 1.690550
C -3.667802 -0.420983 -0.538426
C -1.430969 -0.556244 0.538425
C 1.191959 -1.785526 0.731468
C 2.657758 -2.220551 0.428801
C 2.249546 -0.049815 -0.539687
C 3.261597 -1.004786 -0.259085
C -0.231801 0.161815 -0.148650
C -2.141789 1.739681 2.289406
C -3.698141 -0.244723 2.752189
C -3.043667 -0.452482 -1.956267
C -4.992810 0.370891 -0.594967
C 2.543331 1.153770 -1.220272
C 4.590110 -0.765239 -0.644247
C 3.887897 1.381602 -1.602783
C 4.906454 0.441374 -1.320082
H -4.056751 1.410513 1.401161
H -3.922444 -1.479013 -0.256651
H -1.152518 -0.717904 1.601467
H -1.514808 -1.578128 0.105363
H 0.460334 -2.549864 0.419202
H 1.046916 -1.595095 1.812602
H 2.680661 -3.100794 -0.241083
H 3.195896 -2.498226 1.351983
H -2.589667 2.335610 3.105891
H -1.277950 1.195675 2.717098
H -1.766587 2.419181 1.505608
H -4.486564 -0.897640 2.333812
H -4.115449 0.276083 3.634550
H -2.872392 -0.891142 3.107502
H -3.760145 -0.889821 -2.676625
H -2.783549 0.573031 -2.270127
H -2.119902 -1.056633 -1.997980
H -5.566848 0.317782 0.347014
H -5.628997 -0.049929 -1.394136
H -4.797660 1.432272 -0.834923
H 1.750193 1.870973 -1.434018
H 5.372856 -1.501650 -0.428310
H 4.138634 2.310230 -2.128010
H 5.939041 0.643750 -1.624430


