%chk=000004411.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004411

0 1
 O    2.860300       2.635200       1.387100    
 O    3.903000       1.716900      -2.009200    
 O  -0.1791000     -0.8741000      0.2421000    
 O   -3.075900      -2.325300      -1.402400    
 N   -4.242900      0.1544000     -0.6603000    
 C    2.703800       2.349400     -1.0000000E-03
 C    4.037300       1.910900     -0.6032000    
 C    1.625400       1.275500     -0.1679000    
 C    4.546400      0.6135000      3.0200001E-02
 C    2.107600     -0.1220000      0.1417000    
 C    3.476400     -0.4388000      0.2011000    
 C    1.157300      -1.139300      0.3239000    
 C   -5.026400      0.9859000      0.2434000    
 C    3.865600      -1.759200      0.4770000    
 C   -2.236100      -1.277900     -0.9084000    
 C   -3.073300     -0.3904000      1.5699999E-02
 C   -1.029600      -1.904900     -0.2133000    
 C    1.557400      -2.448900      0.5870000    
 C    2.911400      -2.758300      0.6663000    
 C   -6.244600       1.520300     -0.5172000    
 C   -5.481300      0.1258000       1.427200    
 C   -4.162600       2.151300      0.7400000    
 H    2.349700       3.267200     -0.4851000    
 H    4.797700       2.686100     -0.4520000    
 H    1.266400       1.280800      -1.204700    
 H   0.7813000       1.521500      0.4883000    
 H    4.956900      0.8318000       1.023900    
 H    5.353400      0.2029000     -0.5895000    
 H    4.920200      -2.015300      0.5464000    
 H   -1.897300     -0.6813000      -1.764800    
 H   -2.410900      0.3961000      0.3873000    
 H   -3.365600      -1.027200      0.8562000    
 H   -3.946600      0.6965000      -1.471600    
 H  -0.5343000      -2.562500     -0.9407000    
 H   -1.359800      -2.521900      0.6317000    
 H   0.8496000      -3.252400      0.7664000    
 H    3.226200      -3.775200      0.8817000    
 H    3.539300       3.326500       1.468300    
 H    3.590600       2.554700      -2.391200    
 H   -6.872300       2.144800      0.1288000    
 H   -6.870400      0.7025000     -0.8937000    
 H   -5.943800       2.132800      -1.375500    
 H   -4.683900     -9.0999998E-02   2.145800    
 H   -5.922000     -0.8224000       1.096600    
 H   -6.257700      0.6514000       1.997500    
 H   -4.790200       2.897300       1.243600    
 H   -3.661200       2.667600     -8.7399997E-02
 H   -3.406100       1.855400       1.474300    
 H   -2.549600      -2.852000      -2.027800    


%chk=000004411-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004411

0 1
O 2.705329 2.665275 1.171680
O 4.668473 1.486787 -1.833022
O 0.008918 -0.748875 -0.684351
O -3.389091 -1.985490 -1.347180
N -4.226189 0.403819 -0.538862
C 2.945989 2.302852 -0.241782
C 4.400772 1.804611 -0.416662
C 1.911220 1.235860 -0.613227
C 4.660429 0.527579 0.387490
C 2.268519 -0.172487 -0.169301
C 3.568979 -0.525536 0.260081
C 1.270646 -1.186431 -0.232472
C -5.142119 0.868041 0.562350
C 3.855433 -1.867729 0.620265
C -2.327051 -0.990617 -1.216874
C -2.802989 0.103471 -0.219273
C -1.079128 -1.737938 -0.744631
C 1.548463 -2.522705 0.132364
C 2.854634 -2.855160 0.559176
C -6.497823 1.190983 -0.112462
C -5.339241 -0.277928 1.584882
C -4.594128 2.137275 1.276366
H 2.789116 3.202158 -0.882448
H 5.102446 2.602815 -0.077619
H 1.772491 1.237307 -1.712235
H 0.938967 1.535118 -0.182267
H 4.761089 0.811661 1.453958
H 5.633122 0.111336 0.067707
H 4.868794 -2.132557 0.944804
H -2.111937 -0.519240 -2.202291
H -2.130272 0.982850 -0.259959
H -2.757033 -0.311856 0.802861
H -4.294908 1.044031 -1.344646
H -0.829874 -2.544509 -1.461394
H -1.257796 -2.184328 0.254558
H 0.777393 -3.296289 0.081519
H 3.084070 -3.889734 0.837485
H 3.370824 3.346693 1.448712
H 4.466876 2.282677 -2.389186
H -7.234669 1.527575 0.637999
H -6.898506 0.296886 -0.622343
H -6.387989 1.998452 -0.862864
H -4.407052 -0.516068 2.127587
H -5.683988 -1.194534 1.074772
H -6.094639 0.013988 2.336373
H -5.279829 2.465327 2.079475
H -4.481811 2.973664 0.560293
H -3.607272 1.942397 1.734246
H -4.217959 -1.426779 -1.177053


