%chk=000154470.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154470

0 1
 O   -2.063300      -5.176900       1.098400    
 O   -2.062400      -5.178300      -1.096800    
 O   -5.165700       2.800900      -1.097300    
 O   -5.165900       2.798400       1.097900    
 N    1.362400     -8.7000001E-03 -6.9999998E-04
 N    1.894100       2.156200      3.9999999E-04
 N    3.587000     -0.9843000     -1.5000000E-03
 N    5.311900      0.7423000      9.9999997E-05
 N    4.791700       3.078000      3.0000000E-03
 N   -1.726400      -4.670900      6.0000003E-04
 N   -4.575700       2.652800      1.9999999E-04
 C   0.9081000       1.283500     -6.9999998E-04
 C    2.727200      4.5400001E-02 -6.0000003E-04
 C   0.5915000      -1.172400     -1.0000000E-03
 C    3.036700       1.396100      6.9999998E-04
 C  -0.4962000       1.634300     -3.9999999E-04
 C   0.2137000      -1.742700       1.207300    
 C   0.2135000      -1.743600      -1.208700    
 C    4.386800       1.732100      1.3000000E-03
 C   -1.167800       1.803600      -1.208300    
 C   -1.168100       1.800600       1.207700    
 C  -0.5561000      -2.906000       1.207900    
 C  -0.5565000      -2.906700      -1.208200    
 C  -0.9412000      -3.488000      9.9999997E-05
 C   -2.521000       2.141800      -1.208100    
 C   -2.521500       2.138500       1.207800    
 C   -3.197900       2.309400       0.000000    
 C    4.861200     -0.5355000     -1.1000000E-03
 H   0.5074000      -1.298600       2.155000    
 H   0.5071000      -1.300100      -2.156700    
 H  -0.6531000       1.676100      -2.157600    
 H  -0.6537000       1.670800       2.156800    
 H  -0.8378000      -3.330500       2.168100    
 H  -0.8384000      -3.331800      -2.168000    
 H   -3.015600       2.266300      -2.168100    
 H   -3.016400       2.260500       2.168000    
 H    5.629000      -1.301900     -1.8000000E-03
 H    4.103300       3.818500      3.5000001E-03
 H    5.778700       3.296600      3.1999999E-03


%chk=000154470-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000154470

0 1
O -2.061264 -5.306780 1.140959
O -2.060654 -5.307183 -1.140676
O -5.279201 2.881190 -1.140818
O -5.280735 2.875199 1.140646
N 1.375531 -0.006978 0.000144
N 1.927382 2.223600 -0.000204
N 3.670171 -0.979560 0.000589
N 5.407880 0.764452 0.000233
N 4.912516 3.074590 -0.000313
N -1.734280 -4.800537 0.000138
N -4.694944 2.730726 -0.000079
C 0.913453 1.338345 0.000002
C 2.781043 0.050862 0.000330
C 0.580647 -1.209745 0.000139
C 3.091869 1.437199 -0.000031
C -0.534106 1.680322 -0.000045
C 0.208136 -1.799073 1.230281
C 0.208395 -1.799235 -1.230006
C 4.477998 1.777732 -0.000084
C -1.225278 1.860633 -1.225836
C -1.226993 1.853961 1.225752
C -0.555952 -2.981387 1.236857
C -0.555694 -2.981553 -1.236585
C -0.927852 -3.550565 0.000134
C -2.590596 2.205416 -1.235406
C -2.592315 2.198705 1.235308
C -3.252940 2.366219 -0.000064
C 4.962343 -0.529374 0.000577
H 0.528900 -1.339010 2.169580
H 0.529293 -1.339258 -2.169300
H -0.686824 1.744354 -2.171772
H -0.689881 1.732540 2.171810
H -0.860833 -3.466947 2.167073
H -0.860368 -3.467242 -2.166802
H -3.143039 2.353641 -2.166579
H -3.146035 2.341899 2.166509
H 5.739919 -1.298712 0.000677
H 4.240914 3.839337 -0.000467
H 5.913997 3.258018 -0.000270


