%chk=000081627.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081627

0 1
 O    3.276900      -1.818300      5.0000002E-04
 O   -3.879300      -1.289300     -3.8000001E-03
 N   -1.321200     -0.4112000      2.9000000E-03
 N   -4.731100      0.8460000     -1.8000000E-03
 C   5.3700000E-02 -9.6900001E-02  1.5000000E-03
 C    2.773200      0.5250000     -7.9999998E-04
 C    1.002900      -1.119000      1.0000000E-03
 C    2.362600     -0.8081000     -3.0000001E-04
 C   0.4642000       1.236200      7.9999998E-04
 C    1.823900       1.547100     -3.0000001E-04
 C   -2.345900      0.5864000      3.5999999E-03
 C    4.224200      0.8764000     -2.7999999E-03
 C   -3.704100     -7.4199997E-02 -3.9999999E-04
 H   0.6892000      -2.160400      1.9000000E-03
 H  -0.2411000       2.061700      1.2000001E-03
 H   -1.573200      -1.393700      4.8000002E-03
 H    2.127400       2.590700     -7.9999998E-04
 H   -2.281900       1.214700      0.8999000    
 H   -2.279400       1.218700     -0.8898000    
 H    4.717900      0.4829000      0.8920000    
 H    4.715700      0.4818000     -0.8982000    
 H    4.377300       1.961500     -3.5999999E-03
 H    4.181900      -1.470000     -3.0000001E-04
 H   -5.700300      0.5459000     -4.9000001E-03
 H   -4.563300       1.847100      6.9999998E-04


%chk=000081627-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081627

0 1
O 3.231954 -1.891907 -0.001046
O -3.832801 -1.342898 0.002656
N -1.334139 -0.337940 0.001265
N -4.856590 0.740988 -0.000415
C 0.023973 -0.029182 0.000732
C 2.847599 0.554921 -0.000562
C 0.983425 -1.081948 0.000088
C 2.356202 -0.785450 -0.000524
C 0.491193 1.319782 0.000764
C 1.877830 1.581806 0.000095
C -2.387897 0.651383 0.001197
C 4.339774 0.840272 -0.001216
C -3.747185 -0.080237 0.000380
H 0.670492 -2.131497 -0.000015
H -0.215319 2.155383 0.001496
H -1.656511 -1.310171 0.001973
H 2.220102 2.624719 0.000151
H -2.340425 1.316277 0.894759
H -2.339364 1.316992 -0.891701
H 4.852066 0.430831 0.894699
H 4.851283 0.430860 -0.897604
H 4.522328 1.928277 -0.001305
H 4.173550 -1.587596 -0.001669
H -5.781020 0.310605 0.000253
H -4.780319 1.756730 -0.001455


