%chk=000096440.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096440

0 1
 O    4.349600     -0.8574000     -1.9099999E-02
 N    5.680500       1.043900      5.9000002E-03
 C   -3.139800     -0.5395000      1.7100001E-02
 C   -4.396200      0.3378000      1.0400000E-02
 C   -1.838400      0.2659000      3.0600000E-02
 C   -5.734200     -0.4064000      8.6499996E-02
 C  -0.5827000     -0.6118000      2.4599999E-02
 C   -6.950800      0.5200000      1.5900001E-02
 C   0.7196000      0.1927000      1.3500000E-02
 C   -8.286200     -0.2314000      3.1999999E-03
 C    1.940900     -0.7321000     -2.0500001E-02
 C   -9.503300      0.6893000     -9.4200000E-02
 C    3.252200      4.4300001E-02 -5.7999999E-03
 C   -10.80190     -0.1005000     -2.6600000E-02
 C    5.604500     -0.3054000     -1.2500000E-02
 C    6.706100      -1.145200     -2.4900001E-02
 C    7.968300     -0.5619000     -1.7600000E-02
 C    6.923800       1.574700      1.2200000E-02
 C    8.087900      0.8233000      1.3000000E-03
 H   -3.155800      -1.193000     -0.8636000    
 H   -3.165800      -1.193500      0.8974000    
 H   -4.385300      0.9521000     -0.8990000    
 H   -4.341800       1.036800      0.8548000    
 H   -1.817400      0.9284000     -0.8435000    
 H   -1.821500      0.9110000      0.9177000    
 H   -5.783300      -1.127900     -0.7384000    
 H   -5.772100     -0.9863000       1.016600    
 H  -0.6096000      -1.266300     -0.8556000    
 H  -0.5978000      -1.265300      0.9056000    
 H   -6.881700       1.135800     -0.8894000    
 H   -6.929900       1.208500      0.8695000    
 H   0.7632000      0.8301000      0.9048000    
 H   0.7360000      0.8546000     -0.8605000    
 H   -8.297000     -0.9324000     -0.8408000    
 H   -8.360200     -0.8354000      0.9162000    
 H    1.919100      -1.417000      0.8366000    
 H    1.908100      -1.369400     -0.9130000    
 H   -9.483400       1.418300      0.7241000    
 H   -9.467800       1.253200      -1.033300    
 H    3.292900      0.6943000     -0.8891000    
 H    3.291900      0.6638000      0.8991000    
 H   -10.88020     -0.6473000      0.9185000    
 H   -11.66000      0.5749000     -0.1002000    
 H   -10.86530     -0.8216000     -0.8477000    
 H    6.595700      -2.223900     -3.9700001E-02
 H    8.857100      -1.185600     -2.6699999E-02
 H    6.962600       2.658900      2.7100001E-02
 H    9.061500       1.299600      7.3000002E-03


%chk=000096440-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096440

0 1
O 4.392508 -0.805905 0.031064
N 5.849734 1.063274 -0.028699
C -3.177969 -0.472462 0.010018
C -4.438081 0.422035 0.001009
C -1.857392 0.330247 0.006939
C -5.758733 -0.380598 0.001259
C -0.597626 -0.564191 0.016930
C -7.019399 0.513458 -0.005769
C 0.720647 0.241975 0.009217
C -8.340649 -0.288131 -0.006656
C 1.976419 -0.660165 0.024598
C -9.600349 0.608025 -0.013286
C 3.264179 0.164101 0.007162
C -10.916317 -0.199792 -0.013592
C 5.676745 -0.282544 0.011804
C 6.749136 -1.216873 0.036229
C 8.059306 -0.709001 0.016352
C 7.133812 1.533562 -0.047422
C 8.266344 0.695977 -0.026604
H -3.199801 -1.144843 -0.873264
H -3.203586 -1.132289 0.902590
H -4.411767 1.083073 -0.890647
H -4.417410 1.093199 0.885199
H -1.832212 0.989434 -0.886160
H -1.836277 1.003353 0.889674
H -5.780115 -1.050720 -0.883763
H -5.784553 -1.042990 0.891999
H -0.619320 -1.239021 -0.864134
H -0.620333 -1.220824 0.911627
H -6.993133 1.176471 -0.896101
H -6.998263 1.183188 0.879673
H 0.738813 0.919765 0.888227
H 0.742780 0.895585 -0.887878
H -8.364000 -0.957422 -0.892349
H -8.368852 -0.951468 0.883356
H 1.968421 -1.302474 0.926374
H 1.966128 -1.335984 -0.852325
H -9.575160 1.276963 0.871368
H -9.570688 1.270092 -0.902964
H 3.348867 0.790345 -0.900788
H 3.346920 0.831301 0.885784
H -10.985165 -0.844520 0.883101
H -11.800820 0.463589 -0.021865
H -10.977294 -0.856224 -0.902354
H 6.533063 -2.287660 0.069109
H 8.912153 -1.396016 0.034033
H 7.239108 2.624100 -0.080214
H 9.272280 1.124704 -0.043062


