%chk=000105187.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105187

0 1
 O    2.033300      -1.584600     -0.7152000    
 O   -3.789500     -0.9182000     -8.1200004E-02
 N   -2.298700      0.8547000      6.0000001E-03
 C   -3.293900       1.909500     -5.6699999E-02
 C   -2.600500       3.269400      8.5699998E-02
 C   -4.018300       1.835300      -1.404700    
 C   -4.300800       1.724700       1.084500    
 C   -2.642700     -0.4841000     -1.2300000E-02
 C   -1.509400      -1.439900      8.5500002E-02
 C  -0.2666000      -1.048700     -0.3674000    
 C   0.7970000      -1.946400     -0.2756000    
 C   -1.736600      -2.688700      0.6260000    
 C    2.499900     -0.3293000     -0.3625000    
 C    2.819100      0.5911000      -1.345100    
 C   0.5938000      -3.215300      0.2669000    
 C  -0.6730000      -3.586600      0.7176000    
 C    3.104200       1.229000       1.355600    
 C    2.635100     -3.0400001E-02  0.9822000    
 C    3.288400       1.850600     -0.9717000    
 C    3.431000       2.169400      0.3786000    
 C    2.672200      0.2675000      -2.795500    
 C    3.256000       1.571100       2.799300    
 H   -1.861600       3.421200     -0.7100000    
 H   -3.320800       4.093500      3.6800001E-02
 H   -2.068300       3.343400       1.041300    
 H   -4.593500      0.9128000      -1.530600    
 H   -3.306800       1.891100      -2.237000    
 H   -4.722900       2.668000      -1.514600    
 H   -3.791000       1.625700       2.050100    
 H   -4.968500       2.591900       1.152900    
 H   -4.946900      0.8512000      0.9601000    
 H   -1.335500       1.138400      0.1502000    
 H  -0.1091000     -8.7800004E-02 -0.8460000    
 H   -2.715200      -2.991200      0.9862000    
 H    1.418700      -3.918600      0.3416000    
 H    2.390000     -0.7650000       1.744800    
 H  -0.8306000      -4.574200       1.141200    
 H    3.545900       2.595000      -1.720400    
 H    3.795300       3.154800      0.6568000    
 H    3.240600     -0.6347000      -3.045000    
 H    1.617900      0.1076000      -3.043700    
 H    3.045400       1.075000      -3.434300    
 H    2.316100       1.972500       3.190800    
 H    3.533400      0.6887000       3.385800    
 H    4.044600       2.316200       2.949800    


%chk=000105187-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000105187

0 1
O 2.068741 -1.570757 -0.731630
O -3.997880 -0.933373 -0.196727
N -2.531045 0.824600 0.280673
C -3.536256 1.934442 0.334536
C -2.742422 3.226393 0.645195
C -4.246799 2.061975 -1.037887
C -4.570536 1.657912 1.458264
C -2.816047 -0.500638 0.002960
C -1.625159 -1.435330 -0.035611
C -0.311647 -0.989387 -0.329885
C 0.749436 -1.922576 -0.358133
C -1.865240 -2.812606 0.197383
C 2.593587 -0.277694 -0.445806
C 3.446977 0.275993 -1.435048
C 0.519349 -3.294264 -0.113740
C -0.795671 -3.731932 0.157052
C 2.978336 1.600572 1.085197
C 2.366189 0.356391 0.795258
C 4.054874 1.516982 -1.126217
C 3.827943 2.172684 0.104561
C 3.696121 -0.446220 -2.743065
C 2.719776 2.301642 2.408468
H -1.996458 3.437155 -0.144240
H -3.431889 4.086154 0.698892
H -2.220697 3.152077 1.618908
H -4.773454 1.125921 -1.283738
H -3.515021 2.278956 -1.837026
H -4.982889 2.885747 -1.003533
H -4.070102 1.583482 2.441128
H -5.307347 2.480702 1.502450
H -5.103108 0.713867 1.259349
H -1.573568 1.062353 0.547263
H -0.108572 0.055559 -0.588004
H -2.892958 -3.133754 0.391297
H 1.362756 -3.989749 -0.154418
H 1.727974 -0.129472 1.542084
H -0.982530 -4.795569 0.339217
H 4.721230 1.973372 -1.867779
H 4.318985 3.131498 0.308062
H 4.252855 -1.387590 -2.579620
H 2.747275 -0.727242 -3.234058
H 4.278985 0.183739 -3.436472
H 1.831609 2.960900 2.346716
H 2.535894 1.578424 3.222462
H 3.575602 2.934262 2.702062


