%chk=000001844.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001844

0 1
 O    1.334900      -1.989200     -0.6283000    
 O    2.623600      0.3985000      -1.496000    
 O    4.043100      -1.112900       1.492700    
 O    6.375300     -0.8786000     -8.5800000E-02
 O   3.9700001E-02   2.720200      -1.046300    
 O   -3.796300      -2.123400      0.4068000    
 O   -6.088900      -1.126000      7.3299997E-02
 O   -5.165000      0.9183000     -0.4095000    
 N   1.5500000E-02   1.169600      0.6889000    
 C   4.9699999E-02 -3.1900000E-02 -0.1223000    
 C    1.358400     -0.8038000      0.1777000    
 C    2.654300     -2.4800001E-02 -0.1270000    
 C   -1.219600     -0.8759000      0.1072000    
 C    3.961600     -0.8100000      9.3699999E-02
 C   -2.526100     -0.1114000     -0.1360000    
 C    5.232400     -6.0300000E-02 -0.3042000    
 C   1.3700000E-02   2.441600      0.1497000    
 C   -3.767900     -0.9444000      8.7499999E-02
 C  -5.0999999E-02   3.506200       1.211900    
 C   -5.087300     -0.2618000     -0.1339000    
 H   4.5499999E-02  0.2545000      -1.181700    
 H    1.365600      -1.124900       1.225900    
 H    2.678700      0.8786000      0.4935000    
 H   -1.222000      -1.254300       1.138100    
 H   -1.201500      -1.758700     -0.5437000    
 H    3.933700      -1.764300     -0.4453000    
 H  -1.3600000E-02   1.058700       1.698600    
 H   -2.545200      0.2543000      -1.168900    
 H   -2.588400      0.7475000      0.5410000    
 H    5.212700      0.2196000      -1.361500    
 H    5.351400      0.8425000      0.3043000    
 H    1.244500      -1.720400      -1.558100    
 H    2.720700     -0.3902000      -2.056000    
 H    4.862300      -1.618000       1.632900    
 H   0.7211000       3.333400       1.967100    
 H   0.1144000       4.488100      0.7601000    
 H   -1.036100       3.490100       1.686100    
 H    7.153500     -0.3575000     -0.3474000    
 H   -6.969500     -0.7087000     -3.9299998E-02


%chk=000001844-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001844

0 1
O 1.109896 -1.836737 -2.137586
O 3.555052 -0.976631 -1.993740
O 2.792216 0.037963 1.491077
O 5.424563 0.136004 1.641870
O -0.769112 2.496110 -0.788470
O -3.749547 -2.153529 -0.208642
O -6.059261 -0.731331 0.295158
O -4.772515 0.804520 1.478630
N 0.466657 0.892386 0.366345
C 0.117184 -0.180873 -0.580643
C 1.336957 -1.099994 -0.866479
C 2.724334 -0.364942 -0.952914
C -1.099554 -1.021446 -0.118318
C 3.547404 -0.510420 0.344404
C -2.349682 -0.160746 0.136594
C 4.894654 0.215921 0.262182
C 0.023024 2.186280 0.162017
C -3.633631 -0.961772 0.163548
C 0.533069 3.218272 1.161570
C -4.856615 -0.189345 0.722056
H -0.160344 0.343758 -1.523956
H 1.398511 -1.902880 -0.110209
H 2.569346 0.707765 -1.192249
H -0.834132 -1.570803 0.806454
H -1.321157 -1.787855 -0.885360
H 3.730053 -1.590672 0.517784
H 1.212475 0.691234 1.060269
H -2.450897 0.625010 -0.645331
H -2.272050 0.420273 1.075048
H 5.549102 -0.293505 -0.466587
H 4.745999 1.274527 -0.035362
H 0.600867 -1.257437 -2.762192
H 2.942460 -1.584433 -2.503255
H 3.458023 0.161081 2.220965
H 1.338797 2.828452 1.806675
H 0.897109 4.102333 0.611531
H -0.303691 3.553649 1.799891
H 6.309714 0.568785 1.702837
H -6.817376 -0.218673 0.690190


