%chk=000002536.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002536

0 1
 O   -5.736300      0.4781000     -0.1121000    
 O    1.966100       1.098500      0.1168000    
 O   -3.841100     -0.8032000      0.1835000    
 O   -8.288500      0.9074000     -0.2899000    
 O    1.710000      -1.199200      0.4148000    
 N   -8.948700      -1.310300     -9.6799999E-02
 N    8.083600     -0.4047000      0.5275000    
 N    8.245400     -0.7424000      -1.853900    
 N    10.13080     -0.6390000     -0.5722000    
 C   -2.163600       1.467300     -7.6600000E-02
 C   -3.662900       1.600800     -0.1474000    
 C   -1.427400       1.251500      -1.241600    
 C   -1.511900       1.559200       1.153300    
 C   0.6120000       1.219700      5.3100001E-02
 C  -3.9700001E-02   1.127700      -1.176700    
 C  -0.1242000       1.435400       1.218200    
 C   -4.379800      0.2794000     -3.1000001E-03
 C   -6.546800     -0.6717000      3.7000000E-03
 C    3.901200     -0.2614000      0.3598000    
 C   -8.003800     -0.2845000     -0.1383000    
 C    2.418400     -0.2103000      0.3006000    
 C    4.645400      0.9102000      0.2212000    
 C    4.550000      -1.480900      0.5541000    
 C    6.687000     -0.3570000      0.4714000    
 C    6.038200      0.8624000      0.2771000    
 C    5.942800      -1.528700      0.6098000    
 C   -8.649900      -2.730900      6.5700002E-02
 C   -10.36320     -0.9874000     -0.2381000    
 C    8.756800     -0.5861000     -0.5837000    
 H   -4.010100       2.273800      0.6457000    
 H   -3.945500       2.048400      -1.107800    
 H   -1.923800       1.176000      -2.205400    
 H   -2.074600       1.725100       2.068000    
 H   0.5280000      0.9597000      -2.088000    
 H   0.3774000       1.507900       2.179400    
 H   -6.399400      -1.127400      0.9889000    
 H   -6.290000      -1.377500     -0.7936000    
 H    4.181200       1.880100      6.7900002E-02
 H    3.988500      -2.404800      0.6643000    
 H    6.609800       1.780500      0.1684000    
 H    6.439400      -2.483600      0.7620000    
 H   -9.193800      -3.105200      0.9381000    
 H   -7.586900      -2.925300      0.2087000    
 H   -8.988100      -3.261700     -0.8291000    
 H   -10.75590      -1.505000      -1.118300    
 H   -10.52780      8.6400002E-02 -0.3566000    
 H   -10.89370      -1.330000      0.6552000    
 H    8.857800     -0.8768000      -2.651200    
 H    7.248700     -0.7281000      -2.039800    
 H    10.66320     -0.7780000      -1.424100    
 H    10.65150     -0.5391000      0.2923000    


%chk=000002536-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002536

0 1
O -5.915200 -0.883218 -1.184824
O 1.755488 -0.012637 -0.538233
O -4.615411 -0.378904 0.684846
O -7.453600 1.055595 -0.092860
O 2.635654 -0.942663 -2.521555
N -8.905261 -0.407470 0.998587
N 7.903974 -0.171946 1.260721
N 9.222316 0.807335 -0.525292
N 10.189660 0.173617 1.523444
C -2.417052 0.243514 -1.324754
C -3.911632 0.369548 -1.582370
C -1.574424 -0.343515 -2.297786
C -1.830175 0.721699 -0.123762
C 0.378838 0.027405 -0.903319
C -0.177982 -0.460690 -2.108573
C -0.443144 0.615134 0.086678
C -4.795779 -0.312571 -0.548153
C -6.975892 -1.344775 -0.282886
C 4.105104 -0.389342 -0.661736
C -7.795926 -0.125159 0.212293
C 2.804789 -0.493883 -1.360352
C 4.241813 0.123947 0.659827
C 5.266463 -0.843056 -1.344010
C 6.681996 -0.226384 0.580855
C 5.502336 0.196433 1.269368
C 6.531705 -0.765179 -0.740990
C -9.325458 -1.752462 1.417968
C -9.717407 0.708700 1.514137
C 9.042728 0.242295 0.738728
H -4.219605 1.435615 -1.567354
H -4.180255 -0.017425 -2.578547
H -2.009420 -0.721863 -3.230865
H -2.464985 1.160032 0.652296
H 0.457624 -0.912528 -2.869719
H 0.019541 0.978320 1.009321
H -6.530338 -1.882208 0.575150
H -7.584063 -2.030343 -0.894464
H 3.348939 0.460091 1.193557
H 5.148511 -1.262644 -2.349069
H 5.614531 0.579831 2.288195
H 7.407063 -1.174247 -1.260122
H -9.276487 -1.848905 2.520540
H -8.686939 -2.533571 0.981257
H -10.369023 -1.946558 1.102389
H -10.765135 0.617798 1.169330
H -9.288205 1.649722 1.138717
H -9.706511 0.718590 2.621090
H 10.029945 1.394698 -0.722150
H 8.412198 0.892924 -1.136887
H 11.120088 0.210295 1.116026
H 10.069811 -0.203694 2.460511


