%chk=000081237.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081237

0 1
 O   -1.172300       3.378000     -3.5900000E-02
 O    1.171100      -3.378100      3.1500001E-02
 O    1.022900       3.484300     -0.7202000    
 O   -1.023600      -3.482300      0.7181000    
 N    2.415400       1.376500      0.3951000    
 N   -2.414900      -1.375700     -0.3949000    
 C    1.195400      0.6935000      0.1928000    
 C   -1.194400     -0.6925000     -0.1953000    
 C   3.7700001E-02   1.385500     -0.1638000    
 C  -3.6800001E-02  -1.384500      0.1610000    
 C    1.158100     -0.6914000      0.3549000    
 C   -1.157200      0.6925000     -0.3580000    
 C    3.758800      0.9968000      0.2208000    
 C   -3.757800     -0.9954000     -0.2198000    
 C   4.3400001E-02   2.832200     -0.3409000    
 C  -4.3499999E-02  -2.831000      0.3386000    
 C    4.097800      6.0400002E-02 -0.7558000    
 C    4.751600       1.555400       1.026000    
 C   -4.096200     -6.1299998E-02  0.7594000    
 C   -4.751400      -1.553800      -1.024200    
 C    6.422300      0.2415000     -0.1226000    
 C   -6.421600     -0.2437000      0.1296000    
 C    5.429600     -0.3173000     -0.9276000    
 C    6.083400       1.177700      0.8545000    
 C   -5.428100      0.3146000      0.9340000    
 C   -6.083500      -1.178200     -0.8494000    
 C    7.846200     -0.1611000     -0.3078000    
 C   -7.845200      0.1599000      0.3153000    
 C   -1.293600       4.797900     -0.1725000    
 C    1.290500      -4.798400      0.1658000    
 C   -2.699500       5.211500      0.2070000    
 C    2.695400      -5.213500     -0.2158000    
 H    2.051300      -1.222400      0.6743000    
 H   -2.050800       1.223200     -0.6770000    
 H    2.303300       2.313400      0.7718000    
 H   -2.303300      -2.312500     -0.7720000    
 H    3.349400     -0.3747000      -1.412400    
 H    4.499800       2.284900       1.791500    
 H   -3.347100      0.3726000       1.416000    
 H   -4.500300      -2.282600      -1.790600    
 H    5.681800      -1.045300      -1.694100    
 H    6.847500       1.618600       1.489200    
 H   -5.680200       1.038600       1.704400    
 H   -6.848600      -1.621300      -1.481200    
 H    8.076600      -1.026800      0.3210000    
 H    8.050400     -0.4213000      -1.352100    
 H    8.526000      0.6558000     -4.2800002E-02
 H   -8.328600     -0.4944000       1.047500    
 H   -7.919800       1.195000      0.6660000    
 H   -8.399100      0.1009000     -0.6278000    
 H   -1.090200       5.081900      -1.210900    
 H  -0.5706000       5.289800      0.4875000    
 H   0.5660000      -5.288300     -0.4941000    
 H    1.087900      -5.083700       1.203900    
 H   -3.434000       4.711000     -0.4327000    
 H   -2.922900       4.916500       1.237600    
 H   -2.828000       6.293400      0.1132000    
 H    2.918000      -4.917400      -1.246300    
 H    3.431300      -4.715000      0.4237000    
 H    2.822400      -6.295800     -0.1238000    


%chk=000081237-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081237

0 1
O -1.261108 3.448960 -0.025947
O 1.261288 -3.444115 0.014804
O 1.015185 3.628557 0.393766
O -1.014948 -3.623317 -0.405509
N 2.478886 1.390717 0.273311
N -2.478914 -1.385562 -0.282000
C 1.275947 0.695778 0.122954
C -1.275698 -0.690861 -0.132440
C 0.020829 1.418510 0.064365
C -0.020572 -1.413559 -0.074435
C 1.203309 -0.717623 0.057144
C -1.202995 0.722572 -0.067130
C 3.810867 0.932749 0.120153
C -3.810725 -0.928098 -0.124888
C 0.001389 2.895355 0.159080
C -0.001211 -2.890318 -0.169936
C 4.199310 -0.117101 -0.757820
C 4.830766 1.626693 0.830684
C -4.197329 0.121178 0.754294
C -4.831500 -1.616498 -0.839767
C 6.580966 0.210077 -0.175606
C -6.580023 -0.203694 0.174784
C 5.559746 -0.465651 -0.890593
C 6.185109 1.273636 0.676898
C -5.557201 0.472500 0.886762
C -6.185155 -1.260916 -0.686181
C 8.038756 -0.196650 -0.304030
C -8.043393 0.162923 0.352831
C -1.346841 4.938679 0.064862
C 1.347031 -4.933707 -0.077807
C -2.809483 5.305956 -0.161191
C 2.809567 -5.301312 0.148421
H 2.111190 -1.314195 0.145842
H -2.110856 1.319111 -0.156358
H 2.347474 2.396481 0.475935
H -2.347889 -2.391101 -0.485924
H 3.453956 -0.628588 -1.373176
H 4.549485 2.444199 1.505338
H -3.450434 0.636237 1.364689
H -4.550499 -2.425701 -1.524420
H 5.833072 -1.272623 -1.582197
H 6.948713 1.829208 1.235259
H -5.828396 1.283211 1.574693
H -6.948735 -1.808115 -1.252904
H 8.307832 -0.972383 0.439949
H 8.256769 -0.613537 -1.303583
H 8.714229 0.661742 -0.139288
H -8.507086 -0.419596 1.173357
H -8.166772 1.232177 0.600956
H -8.626344 -0.042176 -0.562820
H -0.676268 5.371286 -0.699372
H -0.977819 5.247440 1.059715
H 0.978471 -5.241229 -1.073214
H 0.676104 -5.367286 0.685568
H -3.152888 4.967675 -1.153588
H -3.455825 4.846675 0.606222
H -2.929712 6.403343 -0.106249
H 3.456282 -4.840937 -0.618019
H 3.152461 -4.964460 1.141487
H 2.929831 -6.398618 0.091967


