%chk=000121696.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121696

0 1
 O   0.4241000       1.705500      0.1211000    
 O    5.955100      -1.355900      0.1759000    
 N   -2.786800     -0.8844000     -0.3209000    
 C   -3.565500      -3.173400     -0.6354000    
 C   -1.819000     -3.4400001E-02 -0.1857000    
 C   -1.990800       1.429200     -5.7300001E-02
 C   -2.356000      -2.269300     -0.4257000    
 C  -0.8479000       2.219700      9.0700001E-02
 C   -4.553100      -3.109400      0.5318000    
 C   0.5873000      0.3381000     -1.0700000E-02
 C  -0.4245000     -0.5308000     -0.1512000    
 C    1.994600     -0.1065000      3.8699999E-02
 C   -3.249200       2.040600     -7.7900000E-02
 C  -0.9567000       3.606600      0.2185000    
 C   -5.756000      -4.008500      0.2914000    
 C   -3.355300       3.428000      4.9500000E-02
 C    2.316600      -1.364000      0.5552000    
 C    3.010800      0.7292000     -0.4315000    
 C   -2.211800       4.210000      0.1978000    
 C    3.646100      -1.783200      0.6014000    
 C    4.340400      0.3100000     -0.3854000    
 C    4.658200     -0.9463000      0.1310000    
 C    6.939700     -0.4509000     -0.3215000    
 H   -3.222000      -4.206500     -0.7682000    
 H   -4.080100      -2.883900      -1.560400    
 H   -1.853300      -2.612100      0.4880000    
 H   -1.720300      -2.429900      -1.306200    
 H   -4.908100      -2.083100      0.6784000    
 H   -4.053300      -3.415400       1.458200    
 H  -0.1819000      -1.575900     -0.2681000    
 H   -4.154900       1.451200     -0.1916000    
 H  -6.7800000E-02   4.221000      0.3341000    
 H   -6.297700      -3.706300     -0.6106000    
 H   -5.448200      -5.052400      0.1744000    
 H   -6.447400      -3.951200       1.138000    
 H   -4.334400       3.898400      3.3199999E-02
 H    1.563500      -2.036400      0.9574000    
 H    2.789900       1.709600     -0.8467000    
 H   -2.299100       5.287900      0.2968000    
 H    3.888600      -2.760300       1.010300    
 H    5.076200       1.008800     -0.7690000    
 H    6.802500     -0.2547000      -1.390300    
 H    7.913500     -0.9386000     -0.2085000    
 H    6.973400      0.4711000      0.2688000    


%chk=000121696-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121696

0 1
O 0.510062 1.586525 -0.062971
O 6.282760 -1.171595 -0.011755
N -2.790145 -1.046780 -0.353892
C -3.974976 -3.210386 -0.547313
C -1.729633 -0.261476 -0.261869
C -1.935720 1.208803 -0.177525
C -2.603790 -2.512313 -0.455762
C -0.817541 2.074909 -0.082579
C -4.821719 -3.041070 0.732844
C 0.729841 0.197540 -0.139878
C -0.325407 -0.684346 -0.235393
C 2.167358 -0.133470 -0.105426
C -3.227696 1.795865 -0.189967
C -0.955429 3.476248 -0.000805
C -6.222587 -3.677719 0.614477
C -3.387508 3.191073 -0.109335
C 2.620378 -1.485780 -0.137365
C 3.145242 0.894291 -0.038616
C -2.248243 4.034118 -0.014288
C 3.986262 -1.793568 -0.105476
C 4.523251 0.599212 -0.005720
C 4.949245 -0.751840 -0.039517
C 7.321940 -0.139046 0.061277
H -3.820685 -4.290168 -0.753057
H -4.526297 -2.787370 -1.410228
H -2.050394 -2.909346 0.427740
H -1.996769 -2.771044 -1.353750
H -4.910280 -1.958916 0.947195
H -4.279155 -3.490677 1.590736
H -0.101148 -1.750552 -0.295952
H -4.081025 1.115066 -0.265925
H -0.058799 4.098927 0.071212
H -6.797818 -3.214008 -0.209309
H -6.153243 -4.762502 0.404450
H -6.804955 -3.550734 1.545906
H -4.391024 3.629330 -0.120201
H 1.902166 -2.310203 -0.184804
H 2.814886 1.935820 -0.012659
H -2.370273 5.120778 0.048417
H 4.337050 -2.829476 -0.128890
H 5.245207 1.419397 0.045775
H 7.287990 0.526984 -0.822285
H 8.272726 -0.691061 0.074280
H 7.225294 0.461760 0.986003


