%chk=000065885.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065885

0 1
 O    3.382600      -2.387500     -0.8852000    
 O    5.920900      -2.517300      0.2392000    
 O  -1.7500000E-02   2.997700     -0.6128000    
 O   -6.830900      0.9201000     -0.8788000    
 N    1.632000       2.119500      0.7690000    
 N   -1.851400       1.197200      0.2059000    
 N   -7.281600      -1.333600     -0.5709000    
 C    3.519100       2.505900     -0.7810000    
 C    2.697000       3.022900      0.3971000    
 C    4.156900       1.165300     -0.5105000    
 C    3.472400     -8.5000005E-03 -0.8253000    
 C    5.430500       1.100100      5.4600000E-02
 C  -0.5413000       1.107000      0.7983000    
 C    4.061500      -1.247900     -0.5751000    
 C   0.3555000       2.184000      0.2285000    
 C    5.335000      -1.313200     -9.8000001E-03
 C    6.019400     -0.1393000      0.3049000    
 C   -2.898800      0.3411000      0.5140000    
 C   -4.137000      0.5013000     -0.1080000    
 C   -5.190000     -0.3590000      0.2027000    
 C   -2.713800     -0.6794000       1.446700    
 C   -5.004900      -1.379600       1.135300    
 C   -3.766700      -1.539900       1.757400    
 C   -6.481600     -0.1920000     -0.4449000    
 C    2.086400      -2.233700      -1.459900    
 C    7.224200      -2.496800      0.8184000    
 C   -8.577800      -1.334200      -1.209900    
 H    4.298100       3.237400      -1.030000    
 H    2.886200       2.430300      -1.674900    
 H    2.266000       3.998200      0.1460000    
 H    3.329300       3.151000       1.282600    
 H    1.841100       1.402800       1.458200    
 H    2.487300      0.1030000      -1.265600    
 H    5.971800       2.008500      0.3057000    
 H  -0.5943000       1.251100       1.883700    
 H  -8.1500001E-02  0.1361000      0.5795000    
 H    7.009900     -0.1135000      0.7457000    
 H   -2.028800       1.926200     -0.4770000    
 H   -4.273300       1.296600     -0.8378000    
 H   -1.767300     -0.8379000       1.955100    
 H   -5.805800      -2.051700       1.429300    
 H   -3.624600      -2.330100       2.489000    
 H    1.693500      -3.239500      -1.641800    
 H    2.132300      -1.730700      -2.431700    
 H    1.393300      -1.743100     -0.7679000    
 H    7.535900      -3.538600      0.9473000    
 H    7.215800      -2.042200       1.815000    
 H    7.954900      -2.026700      0.1515000    
 H   -6.923800      -2.238500     -0.2844000    
 H   -9.059000     -0.3592000      -1.101400    
 H   -8.437500      -1.558200      -2.270300    
 H   -9.192300      -2.109800     -0.7472000    


%chk=000065885-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065885

0 1
O 4.232673 -2.532338 -0.994296
O 6.305330 -2.308739 0.636972
O -0.365345 3.041440 -0.357698
O -7.115122 1.320427 -0.265942
N 1.538117 1.884462 0.339837
N -2.032644 1.021181 0.203791
N -7.810923 -0.900478 -0.261492
C 3.534577 2.464976 -1.072006
C 2.505697 2.938219 -0.005155
C 4.311940 1.230948 -0.633080
C 3.896355 -0.064149 -1.051073
C 5.423592 1.334215 0.230058
C -0.648822 0.772624 0.547785
C 4.571654 -1.227853 -0.620863
C 0.183602 2.005799 0.131685
C 5.695278 -1.107532 0.260872
C 6.109246 0.177571 0.673743
C -3.071446 0.134477 0.454968
C -4.406274 0.491805 0.103836
C -5.481489 -0.387598 0.337200
C -2.846725 -1.140303 1.059857
C -5.249518 -1.649860 0.954332
C -3.931505 -2.007212 1.307309
C -6.853603 0.089253 -0.077249
C 3.121560 -2.695557 -1.934109
C 7.472501 -2.217850 1.517139
C -9.188513 -0.587810 -0.652085
H 4.226569 3.307611 -1.262266
H 2.993981 2.266182 -2.015715
H 1.922373 3.795397 -0.381964
H 3.041587 3.256855 0.910062
H 1.914268 1.001232 0.694666
H 3.050356 -0.148822 -1.741414
H 5.769768 2.321810 0.557023
H -0.514359 0.599832 1.640110
H -0.245757 -0.128760 0.031450
H 6.972264 0.288031 1.336982
H -2.210989 1.946731 -0.200671
H -4.626657 1.466041 -0.347845
H -1.835760 -1.447101 1.347613
H -6.076211 -2.322813 1.208605
H -3.742821 -2.970936 1.794470
H 3.045811 -3.780086 -2.098406
H 3.326959 -2.184631 -2.894979
H 2.170484 -2.316396 -1.509505
H 7.788538 -3.258979 1.676133
H 7.211479 -1.753882 2.488629
H 8.293361 -1.646178 1.041388
H -7.527150 -1.877444 -0.190740
H -9.272783 0.509570 -0.705081
H -9.434173 -1.011060 -1.644361
H -9.914032 -0.970621 0.089981


