%chk=000162526.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162526

0 1
 O   0.1206000       1.527300       2.372000    
 O   0.1222000       1.529000      -2.372400    
 O   -2.991800       3.091800      1.1000000E-03
 N   -1.721500     -0.3302000     -5.0000002E-04
 C  -0.4810000       1.738700     -1.9999999E-04
 C    1.605600      0.7335000      0.6942000    
 C    1.605800      0.7337000     -0.6943000    
 C   0.3783000       1.356300       1.195300    
 C   0.3787000       1.356700      -1.195700    
 C   -1.784900       1.023900     -1.9999999E-04
 C    2.658100      0.2110000       1.420400    
 C    2.658500      0.2112000      -1.420400    
 C    3.746600     -0.3318000      0.7146000    
 C    3.746700     -0.3317000     -0.7143000    
 C   -2.971200       1.735500      9.9999997E-05
 C   -2.873900      -1.026600     -3.0000001E-04
 C   -4.130700     -0.3859000      9.9999997E-05
 C   -4.157000       1.015300      3.9999999E-04
 C    4.844100     -0.8778000       1.397100    
 C    4.844200     -0.8780000      -1.396700    
 C    5.924100      -1.415700      0.6962000    
 C    5.924000      -1.416000     -0.6957000    
 C   -2.848400      -2.418500     -5.0000002E-04
 C   -5.313700      -1.144200      9.9999997E-05
 C   -4.024500      -3.172600     -5.0000002E-04
 C   -5.258900      -2.535000     -1.9999999E-04
 H  -0.5660000       2.831200     -9.9999997E-05
 H    2.640300      0.2224000       2.506200    
 H    2.641000      0.2228000      -2.506200    
 H   -5.109700       1.541300      8.9999998E-04
 H    4.869200     -0.8900000       2.484900    
 H    4.869300     -0.8903000      -2.484600    
 H    6.766600      -1.835100       1.238600    
 H    6.766600      -1.835500      -1.237900    
 H   -1.893900      -2.941700     -6.9999998E-04
 H   -6.285300     -0.6551000      3.9999999E-04
 H   -3.972200      -4.257400     -6.9999998E-04
 H   -3.915900       3.394900      1.4000000E-03
 H   -6.175100      -3.117600     -1.9999999E-04


%chk=000162526-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162526

0 1
O 0.057398 1.247639 2.432951
O 0.057512 1.247960 -2.432658
O -2.832219 3.081171 0.000505
N -1.897367 -0.464244 -0.000149
C -0.474587 1.524153 0.000153
C 1.693836 0.610736 0.716971
C 1.693865 0.610827 -0.716687
C 0.392490 1.129680 1.228842
C 0.392551 1.129865 -1.228547
C -1.843812 0.877509 0.000088
C 2.801354 0.171791 1.440299
C 2.801411 0.171963 -1.440023
C 3.958371 -0.287861 0.729880
C 3.958398 -0.287777 -0.729612
C -3.032788 1.694125 0.000284
C -3.133946 -1.093340 -0.000214
C -4.374170 -0.343892 -0.000024
C -4.288223 1.085107 0.000231
C 5.126513 -0.751904 1.421673
C 5.126566 -0.751739 -1.421415
C 6.246546 -1.196256 0.716372
C 6.246573 -1.196172 -0.716123
C -3.175775 -2.522354 -0.000470
C -5.616985 -1.055480 -0.000098
C -4.402663 -3.191775 -0.000537
C -5.629129 -2.453087 -0.000350
H -0.610701 2.623504 0.000238
H 2.785797 0.176498 2.535942
H 2.785900 0.176806 -2.535665
H -5.208745 1.683463 0.000376
H 5.125727 -0.752100 2.517736
H 5.125821 -0.751810 -2.517479
H 7.132634 -1.547900 1.255515
H 7.132682 -1.547754 -1.255273
H -2.222240 -3.059097 -0.000608
H -6.558134 -0.492360 0.000046
H -4.431800 -4.286662 -0.000734
H -3.690782 3.572696 0.000669
H -6.582978 -2.992130 -0.000405


